2-methyl-N-[(1S,2R)-2-methylcyclohexyl]-6-phenylpyridine-3-carboxamide

C20H24N2O — CID 31847366

IUPAC2-methyl-N-[(1S,2R)-2-methylcyclohexyl]-6-phenylpyridine-3-carboxamide
SMILESCc1nc(-c2ccccc2)ccc1C(=O)N[C@H]1CCCC[C@H]1C
InChIInChI=1S/C20H24N2O/c1-14-8-6-7-11-18(14)22-20(23)17-12-13-19(21-15(17)2)16-9-4-3-5-10-16/h3-5,9-10,12-14,18H,6-8,11H2,1-2H3,(H,22,23)/t14-,18+/m1/s1
InChIKeyRRFSSPXSIYIAKV-KDOFPFPSSA-N
MW308.43 g/mol
LogP4.37
Rot. Bonds3

About 2-methyl-N-[(1S,2R)-2-methylcyclohexyl]-6-phenylpyridine-3-carboxamide

2-methyl-N-[(1S,2R)-2-methylcyclohexyl]-6-phenylpyridine-3-carboxamide (PubChem CID 31847366) has the molecular formula C20H24N2O and a molecular weight of 308.43 g/mol. Its IUPAC name is 2-methyl-N-[(1S,2R)-2-methylcyclohexyl]-6-phenylpyridine-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[(1S,2R)-2-methylcyclohexyl]-6-phenylpyridine-3-carboxamide
PubChem CID31847366
Molecular FormulaC20H24N2O
Molecular Weight308.43 g/mol
Exact Mass308.19
IUPAC Name2-methyl-N-[(1S,2R)-2-methylcyclohexyl]-6-phenylpyridine-3-carboxamide
SMILESCc1nc(-c2ccccc2)ccc1C(=O)N[C@H]1CCCC[C@H]1C
InChIInChI=1S/C20H24N2O/c1-14-8-6-7-11-18(14)22-20(23)17-12-13-19(21-15(17)2)16-9-4-3-5-10-16/h3-5,9-10,12-14,18H,6-8,11H2,1-2H3,(H,22,23)/t14-,18+/m1/s1
InChIKeyRRFSSPXSIYIAKV-KDOFPFPSSA-N
XLogP4.37
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.43
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclohexyl-2-methyl-6-phenylpyridine-3-carboxamide
CID 3410229
N-[2-(aminomethyl)cyclohexyl]-2-methyl-6-phenylpyridine-3-carboxamide;dihydrochloride
CID 119610704
N-[(1R,2R)-2-methylcyclohexyl]-3-phenyl-1H-pyrazole-5-carboxamide
CID 8889054
2-methyl-N-[(1R,2S)-2-methylcyclohexyl]benzamide
CID 804412
2-methyl-6-phenyl-N-piperidin-3-ylpyridine-3-carboxamide;dihydrochloride
CID 119426479
N-(2-methylcyclohexyl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
CID 66497911
N-[(1R)-2-methylcyclohexyl]benzamide
CID 137472316
2-fluoro-N-(2-methylcyclohexyl)benzamide
CID 51166100
N-(2-amino-1-cyclopropylethyl)-2-methyl-6-phenylpyridine-3-carboxamide
CID 119615030
N-(2,3-dimethylcyclohexyl)-2-phenylquinoline-4-carboxamide
CID 5141902
N-(2-methylcyclohexyl)-2-(propan-2-ylamino)benzamide
CID 63107606
2-cyano-N-cyclopropyl-3-(2-methyl-6-phenyl-3-pyridinyl)-3-oxopropanamide
CID 75500431

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(1S,2R)-2-methylcyclohexyl]-6-phenylpyridine-3-carboxamide?
The IUPAC name of 2-methyl-N-[(1S,2R)-2-methylcyclohexyl]-6-phenylpyridine-3-carboxamide (CID 31847366) is 2-methyl-N-[(1S,2R)-2-methylcyclohexyl]-6-phenylpyridine-3-carboxamide.
What is the SMILES notation for 2-methyl-N-[(1S,2R)-2-methylcyclohexyl]-6-phenylpyridine-3-carboxamide?
The canonical SMILES for 2-methyl-N-[(1S,2R)-2-methylcyclohexyl]-6-phenylpyridine-3-carboxamide is Cc1nc(-c2ccccc2)ccc1C(=O)N[C@H]1CCCC[C@H]1C.
What is the InChIKey of 2-methyl-N-[(1S,2R)-2-methylcyclohexyl]-6-phenylpyridine-3-carboxamide?
The InChIKey is RRFSSPXSIYIAKV-KDOFPFPSSA-N. The full InChI is InChI=1S/C20H24N2O/c1-14-8-6-7-11-18(14)22-20(23)17-12-13-19(21-15(17)2)16-9-4-3-5-10-16/h3-5,9-10,12-14,18H,6-8,11H2,1-2H3,(H,22,23)/t14-,18+/m1/s1.
What are the key properties of 2-methyl-N-[(1S,2R)-2-methylcyclohexyl]-6-phenylpyridine-3-carboxamide?
2-methyl-N-[(1S,2R)-2-methylcyclohexyl]-6-phenylpyridine-3-carboxamide has a molecular weight of 308.43 g/mol, XLogP of 4.37, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(1S,2R)-2-methylcyclohexyl]-6-phenylpyridine-3-carboxamide is sourced from PubChem (CID 31847366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).