1-(3-chlorophenyl)-N-cyclopropyl-N-(4-methylcyclohexyl)pyrazole-3-carboxamide

C20H24ClN3O — CID 55924760

IUPAC1-(3-chlorophenyl)-N-cyclopropyl-N-(4-methylcyclohexyl)pyrazole-3-carboxamide
SMILESCC1CCC(N(C(=O)c2ccn(-c3cccc(Cl)c3)n2)C2CC2)CC1
InChIInChI=1S/C20H24ClN3O/c1-14-5-7-16(8-6-14)24(17-9-10-17)20(25)19-11-12-23(22-19)18-4-2-3-15(21)13-18/h2-4,11-14,16-17H,5-10H2,1H3
InChIKeyMPHOJMFXOUVQJF-UHFFFAOYSA-N
MW357.88 g/mol
LogP4.71
Rot. Bonds4

About 1-(3-chlorophenyl)-N-cyclopropyl-N-(4-methylcyclohexyl)pyrazole-3-carboxamide

1-(3-chlorophenyl)-N-cyclopropyl-N-(4-methylcyclohexyl)pyrazole-3-carboxamide (PubChem CID 55924760) has the molecular formula C20H24ClN3O and a molecular weight of 357.88 g/mol. Its IUPAC name is 1-(3-chlorophenyl)-N-cyclopropyl-N-(4-methylcyclohexyl)pyrazole-3-carboxamide.

Molecular Properties

Compound Name1-(3-chlorophenyl)-N-cyclopropyl-N-(4-methylcyclohexyl)pyrazole-3-carboxamide
PubChem CID55924760
Molecular FormulaC20H24ClN3O
Molecular Weight357.88 g/mol
Exact Mass357.16
IUPAC Name1-(3-chlorophenyl)-N-cyclopropyl-N-(4-methylcyclohexyl)pyrazole-3-carboxamide
SMILESCC1CCC(N(C(=O)c2ccn(-c3cccc(Cl)c3)n2)C2CC2)CC1
InChIInChI=1S/C20H24ClN3O/c1-14-5-7-16(8-6-14)24(17-9-10-17)20(25)19-11-12-23(22-19)18-4-2-3-15(21)13-18/h2-4,11-14,16-17H,5-10H2,1H3
InChIKeyMPHOJMFXOUVQJF-UHFFFAOYSA-N
XLogP4.71
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.88
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-(3-chlorophenyl)-N-cyclopropyl-N-(4-methylcyclohexyl)pyrazole-3-carboxamide 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-butyl-1-(3-chlorophenyl)-N-(1,1-dioxothiolan-3-yl)pyrazole-3-carboxamide
CID 55924358
1-(3-chlorophenyl)-N-[2-(2-methylcyclohexyl)oxyethyl]pyrazole-3-carboxamide
CID 55924641
[(3aR,6aS)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl]-[1-(3-chlorophenyl)pyrazol-3-yl]methanone;hydrochloride
CID 120660118
[1-(3-chlorophenyl)pyrazol-3-yl]-(2,3-dimethylpiperazin-1-yl)methanone
CID 120572924
2-[[1-(3-chlorophenyl)pyrazole-3-carbonyl]-(2-methoxyethyl)amino]acetic acid
CID 119189144
[4-(1-aminoethyl)piperidin-1-yl]-[1-(3-chlorophenyl)pyrazol-3-yl]methanone;hydrochloride
CID 119518136
[2-(aminomethyl)piperidin-1-yl]-[1-(3-chlorophenyl)pyrazol-3-yl]methanone
CID 119467359
(4-amino-3,3-dimethylpiperidin-1-yl)-[1-(3-chlorophenyl)pyrazol-3-yl]methanone;hydrochloride
CID 120820060
N-(2-anilino-2-oxoethyl)-1-(3-chlorophenyl)-N-methylpyrazole-3-carboxamide
CID 51122600
4-[[1-(3-chlorophenyl)pyrazole-3-carbonyl]amino]cyclohexane-1-carboxylic acid
CID 119229443
[1-(3-chlorophenyl)pyrazol-3-yl]-[(3R,4R)-3-(dimethylamino)-4-methylsulfanylpyrrolidin-1-yl]methanone
CID 97247160
1-(3-chlorophenyl)-N-[[(2S)-oxolan-2-yl]methyl]pyrazole-3-carboxamide
CID 94676392

Frequently Asked Questions

What is the IUPAC name of 1-(3-chlorophenyl)-N-cyclopropyl-N-(4-methylcyclohexyl)pyrazole-3-carboxamide?
The IUPAC name of 1-(3-chlorophenyl)-N-cyclopropyl-N-(4-methylcyclohexyl)pyrazole-3-carboxamide (CID 55924760) is 1-(3-chlorophenyl)-N-cyclopropyl-N-(4-methylcyclohexyl)pyrazole-3-carboxamide.
What is the SMILES notation for 1-(3-chlorophenyl)-N-cyclopropyl-N-(4-methylcyclohexyl)pyrazole-3-carboxamide?
The canonical SMILES for 1-(3-chlorophenyl)-N-cyclopropyl-N-(4-methylcyclohexyl)pyrazole-3-carboxamide is CC1CCC(N(C(=O)c2ccn(-c3cccc(Cl)c3)n2)C2CC2)CC1.
What is the InChIKey of 1-(3-chlorophenyl)-N-cyclopropyl-N-(4-methylcyclohexyl)pyrazole-3-carboxamide?
The InChIKey is MPHOJMFXOUVQJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24ClN3O/c1-14-5-7-16(8-6-14)24(17-9-10-17)20(25)19-11-12-23(22-19)18-4-2-3-15(21)13-18/h2-4,11-14,16-17H,5-10H2,1H3.
What are the key properties of 1-(3-chlorophenyl)-N-cyclopropyl-N-(4-methylcyclohexyl)pyrazole-3-carboxamide?
1-(3-chlorophenyl)-N-cyclopropyl-N-(4-methylcyclohexyl)pyrazole-3-carboxamide has a molecular weight of 357.88 g/mol, XLogP of 4.71, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chlorophenyl)-N-cyclopropyl-N-(4-methylcyclohexyl)pyrazole-3-carboxamide is sourced from PubChem (CID 55924760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).