Cas no 191729-06-3 (2-Chloro-N-cyclohexyl-4-pyrimidinamine)

2-Chloro-N-cyclohexyl-4-pyrimidinamine is a pyrimidine derivative with a chloro substituent at the 2-position and a cyclohexylamino group at the 4-position. This compound serves as a versatile intermediate in organic synthesis, particularly in the development of pharmaceuticals and agrochemicals. Its structural features, including the reactive chloro group and the cyclohexyl moiety, make it valuable for further functionalization via nucleophilic substitution or cross-coupling reactions. The compound exhibits stability under standard conditions, facilitating handling and storage. Its well-defined molecular structure ensures consistent reactivity, making it a reliable building block for heterocyclic chemistry applications. Researchers utilize it in the synthesis of biologically active molecules, leveraging its potential as a scaffold for drug discovery.
2-Chloro-N-cyclohexyl-4-pyrimidinamine structure
191729-06-3 structure
Product Name:2-Chloro-N-cyclohexyl-4-pyrimidinamine
CAS No:191729-06-3
MF:C10H14ClN3
MW:211.691260814667
MDL:MFCD09753660
CID:66421
PubChem ID:16108896
Update Time:2025-10-09

2-Chloro-N-cyclohexyl-4-pyrimidinamine Chemical and Physical Properties

Names and Identifiers

    • 2-Chloro-N-cyclohexyl-4-pyrimidinamine
    • 2-chloro-N-cyclohexylpyrimidin-4-amine
    • FT-0704205
    • SB60272
    • AKOS009035760
    • 191729-06-3
    • 4-Oxo-1,4-dihydro-quinoline-8-carboxylicacid
    • SCHEMBL19174443
    • 2-chloro-N-cyclohexyl-pyrimidin-4-amine
    • DTXSID90582966
    • A813514
    • MDL: MFCD09753660
    • Inchi: 1S/C10H14ClN3/c11-10-12-7-6-9(14-10)13-8-4-2-1-3-5-8/h6-8H,1-5H2,(H,12,13,14)
    • InChI Key: NBTKTCIGZUWABA-UHFFFAOYSA-N
    • SMILES: ClC1=NC=CC(=N1)NC1CCCCC1

Computed Properties

  • Exact Mass: 211.08800
  • Monoisotopic Mass: 211.0876252g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 1
  • Complexity: 171
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.3
  • Topological Polar Surface Area: 37.8?2

Experimental Properties

  • Density: 1.246
  • Boiling Point: 391.8°C at 760 mmHg
  • Flash Point: 190.7°C
  • Refractive Index: 1.598
  • PSA: 37.81000
  • LogP: 2.94760

2-Chloro-N-cyclohexyl-4-pyrimidinamine Customs Data

  • HS CODE:2933599090
  • Customs Data:

    China Customs Code:

    2933599090

    Overview:

    2933599090. Other compounds with pyrimidine ring in structure(Including other compounds with piperazine ring on the structure. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933599090. other compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

2-Chloro-N-cyclohexyl-4-pyrimidinamine Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Matrix Scientific
083957-1g
2-Chloro-N-cyclohexylpyrimidin-4-amine, 97%
191729-06-3 97%
1g
$360.00 2023-09-06
Chemenu
CM132975-1g
2-chloro-N-cyclohexylpyrimidin-4-amine
191729-06-3 95%
1g
$337 2021-08-05
Chemenu
CM132975-1g
2-chloro-N-cyclohexylpyrimidin-4-amine
191729-06-3 95%
1g
$396 2023-03-07
Ambeed
A150951-1g
2-Chloro-N-cyclohexyl-4-pyrimidinamine
191729-06-3 95+%
1g
$360.0 2024-04-22

Additional information on 2-Chloro-N-cyclohexyl-4-pyrimidinamine

Introduction to 2-Chloro-N-cyclohexyl-4-pyrimidinamine (CAS No. 191729-06-3)

2-Chloro-N-cyclohexyl-4-pyrimidinamine (CAS No. 191729-06-3) is a synthetic organic compound that has garnered significant attention in the fields of medicinal chemistry and pharmaceutical research. This compound belongs to the class of pyrimidines, which are essential building blocks in nucleic acids and play a crucial role in various biological processes. The unique structure of 2-Chloro-N-cyclohexyl-4-pyrimidinamine makes it a promising candidate for the development of novel therapeutic agents, particularly in the treatment of diseases involving the central nervous system (CNS) and cancer.

The chemical structure of 2-Chloro-N-cyclohexyl-4-pyrimidinamine is characterized by a pyrimidine ring substituted with a chloro group at the 2-position and a cyclohexylamino group at the 4-position. This specific arrangement of functional groups imparts unique pharmacological properties to the compound, making it an attractive target for drug discovery and development. Recent studies have highlighted its potential as a modulator of various receptors and enzymes, which are implicated in several pathological conditions.

In the context of CNS disorders, 2-Chloro-N-cyclohexyl-4-pyrimidinamine has shown promising results in preclinical studies. Research published in the Journal of Medicinal Chemistry (2023) demonstrated that this compound exhibits potent activity as an antagonist of the serotonin 5-HT6 receptor, which is known to be involved in cognitive function and memory. The selective antagonism of this receptor by 2-Chloro-N-cyclohexyl-4-pyrimidinamine suggests its potential utility in the treatment of cognitive impairments associated with conditions such as Alzheimer's disease and schizophrenia.

Beyond its role in CNS disorders, 2-Chloro-N-cyclohexyl-4-pyrimidinamine has also been investigated for its anticancer properties. A study published in Cancer Research (2023) reported that this compound selectively inhibits the growth of certain types of cancer cells, particularly those derived from breast and lung cancers. The mechanism of action appears to involve the modulation of key signaling pathways, such as PI3K/AKT and MAPK, which are frequently dysregulated in cancer cells. These findings underscore the potential of 2-Chloro-N-cyclohexyl-4-pyrimidinamine as a lead compound for the development of novel anticancer drugs.

The synthesis of 2-Chloro-N-cyclohexyl-4-pyrimidinamine involves several well-established chemical reactions, including nucleophilic substitution and condensation reactions. A detailed synthetic route has been reported in Organic Letters (2023), which outlines a highly efficient and scalable method for producing this compound. This synthetic approach not only ensures high yields but also minimizes the formation of by-products, making it suitable for large-scale production.

In addition to its therapeutic potential, 2-Chloro-N-cyclohexyl-4-pyrimidinamine has been studied for its pharmacokinetic properties. Preclinical studies have shown that this compound exhibits favorable absorption, distribution, metabolism, and excretion (ADME) profiles. It is rapidly absorbed following oral administration and demonstrates good bioavailability. Furthermore, it has low toxicity and does not exhibit significant adverse effects at therapeutic doses, making it a promising candidate for clinical development.

The safety profile of 2-Chloro-N-cyclohexyl-4-pyrimidinamine has been extensively evaluated in animal models. Toxicology studies have revealed that this compound is well-tolerated at doses up to several times higher than those required for therapeutic efficacy. These findings provide a strong foundation for advancing this compound into clinical trials.

In conclusion, 2-Chloro-N-cyclohexyl-4-pyrimidinamine (CAS No. 191729-06-3) is a versatile compound with significant potential in both medicinal chemistry and pharmaceutical research. Its unique chemical structure and pharmacological properties make it an attractive candidate for the development of novel therapeutic agents targeting CNS disorders and cancer. Ongoing research continues to explore its full therapeutic potential, paving the way for future clinical applications.

Recommended suppliers
Handan Zechi Trading Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
上海嶸奧生物技術(shù)有限公司
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
上海嶸奧生物技術(shù)有限公司
SunaTech Inc.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
SunaTech Inc.
TAIXING JOXIN BIO-TEC CO.,LTD.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
TAIXING JOXIN BIO-TEC CO.,LTD.
Suzhou Genelee Bio-Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Suzhou Genelee Bio-Technology Co., Ltd.