N-cyclohexyl-4-(3-methyl-5-phenylpyrazol-1-yl)benzamide

C23H25N3O — CID 4862165

IUPACN-cyclohexyl-4-(3-methyl-5-phenylpyrazol-1-yl)benzamide
SMILESCc1cc(-c2ccccc2)n(-c2ccc(C(=O)NC3CCCCC3)cc2)n1
InChIInChI=1S/C23H25N3O/c1-17-16-22(18-8-4-2-5-9-18)26(25-17)21-14-12-19(13-15-21)23(27)24-20-10-6-3-7-11-20/h2,4-5,8-9,12-16,20H,3,6-7,10-11H2,1H3,(H,24,27)
InChIKeySCRRNUMUAZTLIL-UHFFFAOYSA-N
MW359.47 g/mol
LogP4.91
Rot. Bonds4

About N-cyclohexyl-4-(3-methyl-5-phenylpyrazol-1-yl)benzamide

N-cyclohexyl-4-(3-methyl-5-phenylpyrazol-1-yl)benzamide (PubChem CID 4862165) has the molecular formula C23H25N3O and a molecular weight of 359.47 g/mol. Its IUPAC name is N-cyclohexyl-4-(3-methyl-5-phenylpyrazol-1-yl)benzamide.

Molecular Properties

Compound NameN-cyclohexyl-4-(3-methyl-5-phenylpyrazol-1-yl)benzamide
PubChem CID4862165
Molecular FormulaC23H25N3O
Molecular Weight359.47 g/mol
Exact Mass359.20
IUPAC NameN-cyclohexyl-4-(3-methyl-5-phenylpyrazol-1-yl)benzamide
SMILESCc1cc(-c2ccccc2)n(-c2ccc(C(=O)NC3CCCCC3)cc2)n1
InChIInChI=1S/C23H25N3O/c1-17-16-22(18-8-4-2-5-9-18)26(25-17)21-14-12-19(13-15-21)23(27)24-20-10-6-3-7-11-20/h2,4-5,8-9,12-16,20H,3,6-7,10-11H2,1H3,(H,24,27)
InChIKeySCRRNUMUAZTLIL-UHFFFAOYSA-N
XLogP4.91
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopentyl-4-(5-phenyltriazol-1-yl)benzamide
CID 16648320
N-(3-methoxypropyl)-4-(3-methyl-5-phenylpyrazol-1-yl)benzamide
CID 4862190
4-(3-methyl-5-phenylpyrazol-1-yl)-N-(4-phenyldiazenylphenyl)benzamide
CID 4862205
N-(2,4-dichlorophenyl)-4-(3-methyl-5-phenylpyrazol-1-yl)benzamide
CID 4862246
N-cyclohexyl-1-methyl-5-phenylpyrazole-3-carboxamide
CID 110336117
(4-methoxycarbonylphenyl) 4-(3-methyl-5-phenylpyrazol-1-yl)benzoate
CID 4862192
4-(3,5-dimethylpyrazol-1-yl)-N-piperidin-3-ylbenzamide;hydrochloride
CID 119429001
N-cycloheptyl-4-(3,5-dimethyl-1,2,4-triazol-4-yl)benzamide
CID 22583363
N-(1-cyclopropylpiperidin-4-yl)-4-(3,5-dimethylpyrazol-1-yl)benzamide
CID 86921667
N-cyclohexyl-4-(3,5-ditert-butylpyrazol-1-yl)benzamide
CID 6736213
4-(3,5-dimethylpyrazol-1-yl)-N-(4-ethylcyclohexyl)benzamide
CID 112816364
N-cycloheptyl-3,5-dimethyl-1-phenylpyrazole-4-carboxamide
CID 9268507

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-(3-methyl-5-phenylpyrazol-1-yl)benzamide?
The IUPAC name of N-cyclohexyl-4-(3-methyl-5-phenylpyrazol-1-yl)benzamide (CID 4862165) is N-cyclohexyl-4-(3-methyl-5-phenylpyrazol-1-yl)benzamide.
What is the SMILES notation for N-cyclohexyl-4-(3-methyl-5-phenylpyrazol-1-yl)benzamide?
The canonical SMILES for N-cyclohexyl-4-(3-methyl-5-phenylpyrazol-1-yl)benzamide is Cc1cc(-c2ccccc2)n(-c2ccc(C(=O)NC3CCCCC3)cc2)n1.
What is the InChIKey of N-cyclohexyl-4-(3-methyl-5-phenylpyrazol-1-yl)benzamide?
The InChIKey is SCRRNUMUAZTLIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O/c1-17-16-22(18-8-4-2-5-9-18)26(25-17)21-14-12-19(13-15-21)23(27)24-20-10-6-3-7-11-20/h2,4-5,8-9,12-16,20H,3,6-7,10-11H2,1H3,(H,24,27).
What are the key properties of N-cyclohexyl-4-(3-methyl-5-phenylpyrazol-1-yl)benzamide?
N-cyclohexyl-4-(3-methyl-5-phenylpyrazol-1-yl)benzamide has a molecular weight of 359.47 g/mol, XLogP of 4.91, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-(3-methyl-5-phenylpyrazol-1-yl)benzamide is sourced from PubChem (CID 4862165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).