N-[1-(hydroxymethyl)cyclohexyl]-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide

C15H22N2O3 — CID 62521639

IUPACN-[1-(hydroxymethyl)cyclohexyl]-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1cc(C)c(C(=O)NC2(CO)CCCCC2)c(=O)[nH]1
InChIInChI=1S/C15H22N2O3/c1-10-8-11(2)16-13(19)12(10)14(20)17-15(9-18)6-4-3-5-7-15/h8,18H,3-7,9H2,1-2H3,(H,16,19)(H,17,20)
InChIKeyVGVXLWJQHICLEG-UHFFFAOYSA-N
MW278.35 g/mol
LogP1.42
Rot. Bonds3

About N-[1-(hydroxymethyl)cyclohexyl]-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide

N-[1-(hydroxymethyl)cyclohexyl]-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 62521639) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is N-[1-(hydroxymethyl)cyclohexyl]-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(hydroxymethyl)cyclohexyl]-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide
PubChem CID62521639
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC NameN-[1-(hydroxymethyl)cyclohexyl]-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1cc(C)c(C(=O)NC2(CO)CCCCC2)c(=O)[nH]1
InChIInChI=1S/C15H22N2O3/c1-10-8-11(2)16-13(19)12(10)14(20)17-15(9-18)6-4-3-5-7-15/h8,18H,3-7,9H2,1-2H3,(H,16,19)(H,17,20)
InChIKeyVGVXLWJQHICLEG-UHFFFAOYSA-N
XLogP1.42
TPSA82.19 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 51.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(hydroxymethyl)oxan-4-yl]-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide
CID 106297578
4,6-dimethyl-N-[[1-(2-methylpropyl)cyclobutyl]methyl]-2-oxo-1H-pyridine-3-carboxamide
CID 131939405
(2R)-2-[(4,6-dimethyl-2-oxo-1H-pyridine-3-carbonyl)amino]propanoic acid
CID 54990799
N-[1-(bromomethyl)cyclohexyl]-2,4,6-trimethylbenzamide
CID 114314026
N-[1-(hydroxymethyl)cyclohexyl]-5-methylthiophene-2-carboxamide
CID 55082075
N-[1-(hydroxymethyl)cyclohexyl]-3-methylbenzamide
CID 62520382
2-ethyl-N-[1-(hydroxymethyl)cyclopentyl]-6-oxo-1H-pyridine-4-carboxamide
CID 167980554
N-[1-(hydroxymethyl)cyclopentyl]-6-methyl-4-methylsulfanyl-2-oxo-1H-pyrimidine-5-carboxamide
CID 62517553
N-ethylsulfonyl-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide
CID 167792286
N-[1-(aminomethyl)cyclopentyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide;hydrochloride
CID 119568364
4,6-dimethyl-N-[(3-methyloxetan-3-yl)methyl]-2-oxo-1H-pyridine-3-carboxamide
CID 78957550
N-(2-methoxyethoxy)-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide
CID 79676518

Frequently Asked Questions

What is the IUPAC name of N-[1-(hydroxymethyl)cyclohexyl]-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-[1-(hydroxymethyl)cyclohexyl]-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide (CID 62521639) is N-[1-(hydroxymethyl)cyclohexyl]-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-[1-(hydroxymethyl)cyclohexyl]-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-[1-(hydroxymethyl)cyclohexyl]-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide is Cc1cc(C)c(C(=O)NC2(CO)CCCCC2)c(=O)[nH]1.
What is the InChIKey of N-[1-(hydroxymethyl)cyclohexyl]-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is VGVXLWJQHICLEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-10-8-11(2)16-13(19)12(10)14(20)17-15(9-18)6-4-3-5-7-15/h8,18H,3-7,9H2,1-2H3,(H,16,19)(H,17,20).
What are the key properties of N-[1-(hydroxymethyl)cyclohexyl]-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide?
N-[1-(hydroxymethyl)cyclohexyl]-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 278.35 g/mol, XLogP of 1.42, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(hydroxymethyl)cyclohexyl]-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 62521639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).