N-(4-aminocyclohexyl)-5-phenyl-1H-pyrazole-4-carboxamide;hydrochloride

C16H21ClN4O — CID 119475103

IUPACN-(4-aminocyclohexyl)-5-phenyl-1H-pyrazole-4-carboxamide;hydrochloride
SMILESCl.NC1CCC(NC(=O)c2cn[nH]c2-c2ccccc2)CC1
InChIInChI=1S/C16H20N4O.ClH/c17-12-6-8-13(9-7-12)19-16(21)14-10-18-20-15(14)11-4-2-1-3-5-11;/h1-5,10,12-13H,6-9,17H2,(H,18,20)(H,19,21);1H
InChIKeyKFHCBZQXUWRPAG-UHFFFAOYSA-N
MW320.82 g/mol
LogP2.50
Rot. Bonds3

About N-(4-aminocyclohexyl)-5-phenyl-1H-pyrazole-4-carboxamide;hydrochloride

N-(4-aminocyclohexyl)-5-phenyl-1H-pyrazole-4-carboxamide;hydrochloride (PubChem CID 119475103) has the molecular formula C16H21ClN4O and a molecular weight of 320.82 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)-5-phenyl-1H-pyrazole-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)-5-phenyl-1H-pyrazole-4-carboxamide;hydrochloride
PubChem CID119475103
Molecular FormulaC16H21ClN4O
Molecular Weight320.82 g/mol
Exact Mass320.14
IUPAC NameN-(4-aminocyclohexyl)-5-phenyl-1H-pyrazole-4-carboxamide;hydrochloride
SMILESCl.NC1CCC(NC(=O)c2cn[nH]c2-c2ccccc2)CC1
InChIInChI=1S/C16H20N4O.ClH/c17-12-6-8-13(9-7-12)19-16(21)14-10-18-20-15(14)11-4-2-1-3-5-11;/h1-5,10,12-13H,6-9,17H2,(H,18,20)(H,19,21);1H
InChIKeyKFHCBZQXUWRPAG-UHFFFAOYSA-N
XLogP2.50
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.82
LogP ≤ 52.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-(4-aminocyclohexyl)-5-phenyl-1H-pyrazole-4-carboxamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(1,1-dioxothian-4-yl)-5-phenyl-1H-pyrazole-4-carboxamide
CID 60511818
N-(1-ethylpiperidin-4-yl)-5-phenyl-1H-pyrazole-4-carboxamide
CID 146131304
N-cyclopropyl-5-(4-nitrophenyl)-1H-pyrazole-4-carboxamide
CID 71824219
5-(4-fluorophenyl)-N-(4-methylcyclohexyl)-1H-pyrazole-4-carboxamide
CID 24595329
5-(3-bromophenyl)-N-cyclopentyl-1H-pyrazole-4-carboxamide
CID 71824533
N-(1-benzylpiperidin-4-yl)-5-(4-chlorophenyl)-1H-pyrazole-4-carboxamide
CID 46341484
N-(4-aminocyclohexyl)-2-methylbenzamide
CID 43653114
N-cycloheptyl-5-(4-methoxyphenyl)-1H-pyrazole-4-carboxamide
CID 78835476
3-[(5-phenyl-1H-pyrazole-4-carbonyl)amino]propanoic acid
CID 43354670
N-[1-(hydroxymethyl)cyclopentyl]-5-phenyl-1H-pyrazole-4-carboxamide
CID 62518947
N-(4-aminocyclohexyl)-5-cyclopropyl-1-phenylpyrazole-4-carboxamide;hydrochloride
CID 119477727
N-(4-aminocyclohexyl)-2-phenylsulfanylbenzamide;hydrochloride
CID 119478534

Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)-5-phenyl-1H-pyrazole-4-carboxamide;hydrochloride?
The IUPAC name of N-(4-aminocyclohexyl)-5-phenyl-1H-pyrazole-4-carboxamide;hydrochloride (CID 119475103) is N-(4-aminocyclohexyl)-5-phenyl-1H-pyrazole-4-carboxamide;hydrochloride.
What is the SMILES notation for N-(4-aminocyclohexyl)-5-phenyl-1H-pyrazole-4-carboxamide;hydrochloride?
The canonical SMILES for N-(4-aminocyclohexyl)-5-phenyl-1H-pyrazole-4-carboxamide;hydrochloride is Cl.NC1CCC(NC(=O)c2cn[nH]c2-c2ccccc2)CC1.
What is the InChIKey of N-(4-aminocyclohexyl)-5-phenyl-1H-pyrazole-4-carboxamide;hydrochloride?
The InChIKey is KFHCBZQXUWRPAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O.ClH/c17-12-6-8-13(9-7-12)19-16(21)14-10-18-20-15(14)11-4-2-1-3-5-11;/h1-5,10,12-13H,6-9,17H2,(H,18,20)(H,19,21);1H.
What are the key properties of N-(4-aminocyclohexyl)-5-phenyl-1H-pyrazole-4-carboxamide;hydrochloride?
N-(4-aminocyclohexyl)-5-phenyl-1H-pyrazole-4-carboxamide;hydrochloride has a molecular weight of 320.82 g/mol, XLogP of 2.50, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)-5-phenyl-1H-pyrazole-4-carboxamide;hydrochloride is sourced from PubChem (CID 119475103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).