N-(4-hydroxycyclohexyl)-1,3-diphenylpyrazole-5-carboxamide

C22H23N3O2 — CID 9324133

IUPACN-(4-hydroxycyclohexyl)-1,3-diphenylpyrazole-5-carboxamide
SMILESO=C(NC1CCC(O)CC1)c1cc(-c2ccccc2)nn1-c1ccccc1
InChIInChI=1S/C22H23N3O2/c26-19-13-11-17(12-14-19)23-22(27)21-15-20(16-7-3-1-4-8-16)24-25(21)18-9-5-2-6-10-18/h1-10,15,17,19,26H,11-14H2,(H,23,27)
InChIKeyWVRFBRVXUQXRCI-UHFFFAOYSA-N
MW361.44 g/mol
LogP3.57
Rot. Bonds4

About N-(4-hydroxycyclohexyl)-1,3-diphenylpyrazole-5-carboxamide

N-(4-hydroxycyclohexyl)-1,3-diphenylpyrazole-5-carboxamide (PubChem CID 9324133) has the molecular formula C22H23N3O2 and a molecular weight of 361.44 g/mol. Its IUPAC name is N-(4-hydroxycyclohexyl)-1,3-diphenylpyrazole-5-carboxamide.

Molecular Properties

Compound NameN-(4-hydroxycyclohexyl)-1,3-diphenylpyrazole-5-carboxamide
PubChem CID9324133
Molecular FormulaC22H23N3O2
Molecular Weight361.44 g/mol
Exact Mass361.18
IUPAC NameN-(4-hydroxycyclohexyl)-1,3-diphenylpyrazole-5-carboxamide
SMILESO=C(NC1CCC(O)CC1)c1cc(-c2ccccc2)nn1-c1ccccc1
InChIInChI=1S/C22H23N3O2/c26-19-13-11-17(12-14-19)23-22(27)21-15-20(16-7-3-1-4-8-16)24-25(21)18-9-5-2-6-10-18/h1-10,15,17,19,26H,11-14H2,(H,23,27)
InChIKeyWVRFBRVXUQXRCI-UHFFFAOYSA-N
XLogP3.57
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.44
LogP ≤ 53.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(4-hydroxycyclohexyl)-1,3-diphenylpyrazole-5-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-[(2R,3S,4S)-3-hydroxy-2-(hydroxymethyl)oxan-4-yl]-1,3-diphenylpyrazole-5-carboxamide
CID 154565232
1-(4-chlorophenyl)-N-cyclopropyl-3-(3,4-dimethylphenyl)pyrazole-5-carboxamide
CID 4025891
N-cyclopropyl-3-(2-fluorophenyl)-1-(4-fluorophenyl)pyrazole-5-carboxamide
CID 812037
N-[(1S,2R,4R)-7-oxabicyclo[2.2.1]heptan-2-yl]-1,3-diphenylpyrazole-5-carboxamide
CID 167921002
3-cyclopropyl-N-(4-methylcyclohexyl)-1-phenylpyrazole-5-carboxamide
CID 9462634
3-(2-chlorophenyl)-N-cyclohexyl-1-phenylpyrazole-5-carboxamide
CID 4521775
[2-[(4-methylcyclohexyl)amino]-2-oxoethyl] 1,3-diphenylpyrazole-5-carboxylate
CID 7211160
3-(2-chlorophenyl)-N-cyclopropyl-1-(4-fluorophenyl)pyrazole-5-carboxamide
CID 4005097
N-(4-aminocyclohexyl)-3-(furan-2-yl)-1-phenylpyrazole-5-carboxamide;hydrochloride
CID 119474454
N-cyclohexyl-1-(4-fluorophenyl)-3-(3-methoxyphenyl)pyrazole-5-carboxamide
CID 4266674
N-cyclopropyl-6-oxo-1-phenylpyridazine-3-carboxamide
CID 31900847
N-[(1R)-1-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-1,3-diphenylpyrazole-5-carboxamide
CID 98297174

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxycyclohexyl)-1,3-diphenylpyrazole-5-carboxamide?
The IUPAC name of N-(4-hydroxycyclohexyl)-1,3-diphenylpyrazole-5-carboxamide (CID 9324133) is N-(4-hydroxycyclohexyl)-1,3-diphenylpyrazole-5-carboxamide.
What is the SMILES notation for N-(4-hydroxycyclohexyl)-1,3-diphenylpyrazole-5-carboxamide?
The canonical SMILES for N-(4-hydroxycyclohexyl)-1,3-diphenylpyrazole-5-carboxamide is O=C(NC1CCC(O)CC1)c1cc(-c2ccccc2)nn1-c1ccccc1.
What is the InChIKey of N-(4-hydroxycyclohexyl)-1,3-diphenylpyrazole-5-carboxamide?
The InChIKey is WVRFBRVXUQXRCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O2/c26-19-13-11-17(12-14-19)23-22(27)21-15-20(16-7-3-1-4-8-16)24-25(21)18-9-5-2-6-10-18/h1-10,15,17,19,26H,11-14H2,(H,23,27).
What are the key properties of N-(4-hydroxycyclohexyl)-1,3-diphenylpyrazole-5-carboxamide?
N-(4-hydroxycyclohexyl)-1,3-diphenylpyrazole-5-carboxamide has a molecular weight of 361.44 g/mol, XLogP of 3.57, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxycyclohexyl)-1,3-diphenylpyrazole-5-carboxamide is sourced from PubChem (CID 9324133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).