Cas no 93138-61-5 ((1-benzylpyrrolidin-3-yl)methanamine)

(1-benzylpyrrolidin-3-yl)methanamine structure
93138-61-5 structure
Product Name:(1-benzylpyrrolidin-3-yl)methanamine
CAS No:93138-61-5
MF:C12H18N2
MW:190.284722805023
MDL:MFCD06411056
CID:809339
PubChem ID:3157467
Update Time:2024-10-26

(1-benzylpyrrolidin-3-yl)methanamine Chemical and Physical Properties

Names and Identifiers

    • 3-(Aminomethyl)-1-benzylpyrrolidine
    • (1-Benzylpyrrolidin-3-yl)methanamine
    • 1-Benzyl-3-aminomethylpyrrolidine
    • 3-Pyrrolidinemethanamine,1-(phenylmethyl)-
    • C-(1-Benzyl-pyrrolidin-3-yl)-methylamine
    • 1-(Phenylmethyl)-3-pyrrolidinemethanamine (ACI)
    • Pyrrolidine, 3-(aminomethyl)-1-benzyl- (7CI)
    • 1-Benzyl-3-pyrrolidinemethanamine
    • 3-Aminomethyl-1-benzylpyrrolidine
    • [(1-Benzylpyrrolidin-3-yl)methyl]amine
    • 3-Aminomethyl-1-benzyl-pyrrolidine
    • STK894460
    • (1-benzylpyrrolidin-3-ylmethyl)amine
    • AB25146
    • EN300-64541
    • SCHEMBL1180490
    • AB01329838-02
    • 93138-61-5
    • (R)-1-Benzyl-3-aminomethylpyrrolidine
    • 1-Benzyl-3-(Aminomethyl)pyrrolidine
    • (s)-1-benzyl-3-aminomethylpyrrolidine
    • SB44888
    • J-504276
    • 1-Benzyl-3-aminomethylpyrrolidine, AldrichCPR
    • 1-(1-BENZYL-3-PYRROLIDINYL)METHANAMINE
    • (1-Benzylpyrrolidin-3-yl)methylamine
    • SY007867
    • 1-(1-benzylpyrrolidin-3-yl)methanamine
    • [(1-Benzylpyrrolidin-3-yl)methyl]amine dihydrochloride
    • BBL021743
    • AKOS016050314
    • DTXSID50390125
    • 3-(RS)-aminomethyl-1-benzylpyrrolidine
    • DB-012494
    • AKOS000170600
    • N-benzyl-3(RS)-aminomethylpyrrolidine
    • PS-4935
    • CS-0197519
    • DB-079487
    • MFCD06411056
    • NCGC00338182-01
    • SUAKIVNGQVUKJA-UHFFFAOYSA-N
    • HMS1704B01
    • Z317027120
    • 3-Pyrrolidinemethanamine, 1-(phenylmethyl)-
    • ALBB-013306
    • (1-benzylpyrrolidin-3-yl)methanamine
    • MDL: MFCD06411056
    • Inchi: 1S/C12H18N2/c13-8-12-6-7-14(10-12)9-11-4-2-1-3-5-11/h1-5,12H,6-10,13H2
    • InChI Key: SUAKIVNGQVUKJA-UHFFFAOYSA-N
    • SMILES: NCC1CCN(CC2C=CC=CC=2)C1

Computed Properties

  • Exact Mass: 190.147
  • Monoisotopic Mass: 190.147
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 164
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 29.3A^2
  • XLogP3: 1.2

Experimental Properties

  • Color/Form: No data avaiable
  • Density: 1.0±0.1 g/cm3
  • Melting Point: No data available
  • Boiling Point: 284.3℃ at 760 mmHg
  • Flash Point: 115.3℃
  • Vapor Pressure: No data available

(1-benzylpyrrolidin-3-yl)methanamine Security Information

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(1-benzylpyrrolidin-3-yl)methanamine Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: Hydrochloric acid Solvents: Ethanol ,  Water ;  reflux
Reference
Synthesis of N-substituted pyrrolidinemethanamine
Wang, Xue-tao; Ge, Min, Huaxue Shiji, 2010, 32(11), 986-988

Production Method 2

Reaction Conditions
1.1 Reagents: Lithium aluminum hydride Solvents: Tetrahydrofuran ;  cooled; 1.5 h, reflux; cooled
1.2 Reagents: Potassium sodium tartrate Solvents: Water ;  cooled
Reference
Preparation of novel mutilin derivatives as antibacterial agents
, World Intellectual Property Organization, , ,

Production Method 3

Reaction Conditions
1.1 Reagents: Lithium aluminum hydride Solvents: Tetrahydrofuran ;  0 °C → rt; 18 h, rt
Reference
Preparation of indole, azaindole and related heterocyclic pyrrolidine derivatives as antiviral agents
, World Intellectual Property Organization, , ,

Production Method 4

Reaction Conditions
Reference
Preparation of N-pyrrolidinylmethylalkanoamides and analogs as CCR-3 receptor antagonists
, Germany, , ,

Production Method 5

Reaction Conditions
Reference
Synthesis and pharmacological evaluation of carboxamide derivatives as selective serotoninergic 5-HT4 receptor agonists
Itoh, Katsuhiko; Kanzaki, Koji; Ikebe, Tsuguo; Kuroita, Takanobu; Tomozane, Hideo; et al, European Journal of Medicinal Chemistry, 1999, 34(11), 977-989

Production Method 6

Reaction Conditions
1.1 Reagents: Lithium aluminum hydride Solvents: Tetrahydrofuran ;  3 h, 50 °C; cooled
1.2 Reagents: Ammonium chloride Solvents: Water
1.3 Reagents: Sodium hydroxide Solvents: Ethyl acetate ,  Water ;  20 min
Reference
Preparation of tartaric acid functional compounds for the treatment of disorders mediated by MMPs, aggrecanase, ADMP, LpxC, ADAMs, TACE and TNF-α
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Production Method 7

Reaction Conditions
1.1 Reagents: Triphenylphosphine ,  Water Solvents: Tetrahydrofuran ;  24 h, rt → reflux
Reference
Preparation of pyrimidines and related compounds as alpha 1a adrenergic receptor antagonists
, World Intellectual Property Organization, , ,

Production Method 8

Reaction Conditions
Reference
Preparation of tartaric acid functional compounds for the treatment of inflammatory disorders mediated by MMPs, aggrecanase, ADMP, LpxC, ADAMs, TACE and TNF-α
, United States, , ,

Production Method 9

Reaction Conditions
Reference
Preparation of tartaric acid functional compounds for the treatment of inflammatory disorders
, World Intellectual Property Organization, , ,

Production Method 10

Reaction Conditions
Reference
1-(Heteroaryl)-azetidines and -pyrrolidines as 5-HT3 receptor agonists
, European Patent Organization, , ,

(1-benzylpyrrolidin-3-yl)methanamine Raw materials

(1-benzylpyrrolidin-3-yl)methanamine Preparation Products

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