N-(cyclohexylmethyl)-N,6-dimethylpyridine-3-carboxamide

C15H22N2O — CID 39975112

IUPACN-(cyclohexylmethyl)-N,6-dimethylpyridine-3-carboxamide
SMILESCc1ccc(C(=O)N(C)CC2CCCCC2)cn1
InChIInChI=1S/C15H22N2O/c1-12-8-9-14(10-16-12)15(18)17(2)11-13-6-4-3-5-7-13/h8-10,13H,3-7,11H2,1-2H3
InChIKeyPEWXAJJNYRRRJL-UHFFFAOYSA-N
MW246.35 g/mol
LogP3.04
Rot. Bonds3

About N-(cyclohexylmethyl)-N,6-dimethylpyridine-3-carboxamide

N-(cyclohexylmethyl)-N,6-dimethylpyridine-3-carboxamide (PubChem CID 39975112) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-N,6-dimethylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-N,6-dimethylpyridine-3-carboxamide
PubChem CID39975112
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC NameN-(cyclohexylmethyl)-N,6-dimethylpyridine-3-carboxamide
SMILESCc1ccc(C(=O)N(C)CC2CCCCC2)cn1
InChIInChI=1S/C15H22N2O/c1-12-8-9-14(10-16-12)15(18)17(2)11-13-6-4-3-5-7-13/h8-10,13H,3-7,11H2,1-2H3
InChIKeyPEWXAJJNYRRRJL-UHFFFAOYSA-N
XLogP3.04
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,6-dimethyl-N-(pyrrolidin-2-ylmethyl)pyridine-3-carboxamide
CID 106607470
N-(cyclohexylmethyl)-4-hydroxy-N-methylbenzamide
CID 54948596
N-[[1-[2-(4-chlorophenyl)ethyl]piperidin-3-yl]methyl]-N,6-dimethylpyridine-3-carboxamide
CID 45240100
N-(cyclopropylmethyl)-N-methyl-6-(methylamino)pyridine-3-carboxamide
CID 62179892
cyclohexyl-(6-methyl-3-pyridinyl)methanone
CID 63155759
N-(2-chloroethyl)-N-cyclohexyl-6-methylpyridine-3-carboxamide
CID 63391189
N-(cyclopropylmethyl)-6-(ethylamino)-N-methylpyridine-3-carboxamide
CID 62180065
methyl 2-[methyl-(6-methylpyridine-3-carbonyl)amino]acetate
CID 43409840
N-(2-chlorocyclohexyl)-N,6-dimethylpyridine-3-carboxamide
CID 102638056
6-amino-N-methyl-N-(oxan-3-ylmethyl)pyridine-3-carboxamide
CID 63706952
6-chloro-N-methyl-N-(oxan-3-ylmethyl)pyridine-3-carboxamide
CID 63711414
N-(cyclopentylmethyl)-4-(N'-hydroxycarbamimidoyl)-N-methylbenzamide
CID 77003917

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-N,6-dimethylpyridine-3-carboxamide?
The IUPAC name of N-(cyclohexylmethyl)-N,6-dimethylpyridine-3-carboxamide (CID 39975112) is N-(cyclohexylmethyl)-N,6-dimethylpyridine-3-carboxamide.
What is the SMILES notation for N-(cyclohexylmethyl)-N,6-dimethylpyridine-3-carboxamide?
The canonical SMILES for N-(cyclohexylmethyl)-N,6-dimethylpyridine-3-carboxamide is Cc1ccc(C(=O)N(C)CC2CCCCC2)cn1.
What is the InChIKey of N-(cyclohexylmethyl)-N,6-dimethylpyridine-3-carboxamide?
The InChIKey is PEWXAJJNYRRRJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-12-8-9-14(10-16-12)15(18)17(2)11-13-6-4-3-5-7-13/h8-10,13H,3-7,11H2,1-2H3.
What are the key properties of N-(cyclohexylmethyl)-N,6-dimethylpyridine-3-carboxamide?
N-(cyclohexylmethyl)-N,6-dimethylpyridine-3-carboxamide has a molecular weight of 246.35 g/mol, XLogP of 3.04, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-N,6-dimethylpyridine-3-carboxamide is sourced from PubChem (CID 39975112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).