Cas no 553671-80-0 (1H-PYRAZOLE-5-CARBOXAMIDE, 4-AMINO-1-CYCLOHEXYL-3-METHYL-)
553671-80-0 structure
Product Name:1H-PYRAZOLE-5-CARBOXAMIDE, 4-AMINO-1-CYCLOHEXYL-3-METHYL-
CAS No:553671-80-0
MF:C11H18N4O
MW:222.286821842194
CID:3233218
PubChem ID:23024311
Update Time:2025-04-21
1H-PYRAZOLE-5-CARBOXAMIDE, 4-AMINO-1-CYCLOHEXYL-3-METHYL- Chemical and Physical Properties
Names and Identifiers
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- 1H-PYRAZOLE-5-CARBOXAMIDE, 4-AMINO-1-CYCLOHEXYL-3-METHYL-
- 4-amino-1-cyclohexyl-3-methyl-1H-pyrazole-5-carboxamide(WXG03008)
- 4-amino-1-cyclohexyl-3-methyl-1H-pyrazole-5-carboxamide
- SCHEMBL1814476
- 553671-80-0
-
- Inchi: 1S/C11H18N4O/c1-7-9(12)10(11(13)16)15(14-7)8-5-3-2-4-6-8/h8H,2-6,12H2,1H3,(H2,13,16)
- InChI Key: VOVSUIJHMGNHAI-UHFFFAOYSA-N
- SMILES: N1(C2CCCCC2)C(C(N)=O)=C(N)C(C)=N1
Computed Properties
- Exact Mass: 222.14806121Da
- Monoisotopic Mass: 222.14806121Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 265
- 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: 1.4
- Topological Polar Surface Area: 86.9?2
1H-PYRAZOLE-5-CARBOXAMIDE, 4-AMINO-1-CYCLOHEXYL-3-METHYL- Related Literature
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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3. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
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Xu Jie,Deng Xu,Weili Wei RSC Adv., 2019,9, 29149-29153
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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