4-methyl-6-[2-(2-oxo-1H-pyridin-3-yl)propyl]-1H-pyridin-2-one

C14H16N2O2 — CID 134461758

IUPAC4-methyl-6-[2-(2-oxo-1H-pyridin-3-yl)propyl]-1H-pyridin-2-one
SMILESCc1cc(CC(C)c2ccc[nH]c2=O)[nH]c(=O)c1
InChIInChI=1S/C14H16N2O2/c1-9-6-11(16-13(17)7-9)8-10(2)12-4-3-5-15-14(12)18/h3-7,10H,8H2,1-2H3,(H,15,18)(H,16,17)
InChIKeyILVMEMMSZVQRCU-UHFFFAOYSA-N
MW244.29 g/mol
LogP1.72
Rot. Bonds3

About 4-methyl-6-[2-(2-oxo-1H-pyridin-3-yl)propyl]-1H-pyridin-2-one

4-methyl-6-[2-(2-oxo-1H-pyridin-3-yl)propyl]-1H-pyridin-2-one (PubChem CID 134461758) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 4-methyl-6-[2-(2-oxo-1H-pyridin-3-yl)propyl]-1H-pyridin-2-one.

Molecular Properties

Compound Name4-methyl-6-[2-(2-oxo-1H-pyridin-3-yl)propyl]-1H-pyridin-2-one
PubChem CID134461758
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name4-methyl-6-[2-(2-oxo-1H-pyridin-3-yl)propyl]-1H-pyridin-2-one
SMILESCc1cc(CC(C)c2ccc[nH]c2=O)[nH]c(=O)c1
InChIInChI=1S/C14H16N2O2/c1-9-6-11(16-13(17)7-9)8-10(2)12-4-3-5-15-14(12)18/h3-7,10H,8H2,1-2H3,(H,15,18)(H,16,17)
InChIKeyILVMEMMSZVQRCU-UHFFFAOYSA-N
XLogP1.72
TPSA65.72 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1,2,3,4-Tetrahydro-1,6-naphthyridin-5-ol
CID 15232997
N-cyclopentyl-2-[1-[(1-methyl-2-oxo-4-pyridinyl)methyl]piperidin-4-yl]acetamide
CID 75462203
N-(3-methylbutyl)-2-(5-oxo-1,2,3,4-tetrahydro-1,6-naphthyridin-6-yl)acetamide
CID 90655130
N-(3-methylbutyl)-2-(1-methyl-5-oxo-3,4-dihydro-2H-1,6-naphthyridin-6-yl)acetamide
CID 90670066
7-(dimethylamino)-3,4-dimethyl-4a,8a-dihydro-1H-quinolin-2-one
CID 176468600
6-ethyl-2-oxo-N-(piperidin-3-ylmethyl)-1,2-dihydropyridine-4-carboxamide
CID 74244916
N-ethyl-2-[[4-(trifluoromethyl)cyclohexa-2,4-diene-1-carbonyl]amino]cyclohexa-1,3-diene-1-carboxamide
CID 134460192
6-ethenyl-5-(1-fluoroethenyl)-3-piperidin-4-yl-1H-pyridin-2-one
CID 143228143
5-[5-[(3E,5E)-6-fluorohexa-1,3,5-trien-3-yl]-4-methyl-2-oxo-1-pyridinyl]-N-methylcyclohexa-2,4-diene-1-carboxamide
CID 147443672
2-Hydroxy-3-(sec-butyl)pyridine
CID 14616757
carbanide;1-methyl-N-(3-methyl-4-oxopentan-2-yl)-4-oxo-7H-quinolin-7-ide-3-carboxamide;uranium(2+)
CID 18685828
N-[(6-butyl-2-oxo-1H-pyridin-3-yl)methyl]butanamide
CID 19012292

Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-[2-(2-oxo-1H-pyridin-3-yl)propyl]-1H-pyridin-2-one?
The IUPAC name of 4-methyl-6-[2-(2-oxo-1H-pyridin-3-yl)propyl]-1H-pyridin-2-one (CID 134461758) is 4-methyl-6-[2-(2-oxo-1H-pyridin-3-yl)propyl]-1H-pyridin-2-one.
What is the SMILES notation for 4-methyl-6-[2-(2-oxo-1H-pyridin-3-yl)propyl]-1H-pyridin-2-one?
The canonical SMILES for 4-methyl-6-[2-(2-oxo-1H-pyridin-3-yl)propyl]-1H-pyridin-2-one is Cc1cc(CC(C)c2ccc[nH]c2=O)[nH]c(=O)c1.
What is the InChIKey of 4-methyl-6-[2-(2-oxo-1H-pyridin-3-yl)propyl]-1H-pyridin-2-one?
The InChIKey is ILVMEMMSZVQRCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-9-6-11(16-13(17)7-9)8-10(2)12-4-3-5-15-14(12)18/h3-7,10H,8H2,1-2H3,(H,15,18)(H,16,17).
What are the key properties of 4-methyl-6-[2-(2-oxo-1H-pyridin-3-yl)propyl]-1H-pyridin-2-one?
4-methyl-6-[2-(2-oxo-1H-pyridin-3-yl)propyl]-1H-pyridin-2-one has a molecular weight of 244.29 g/mol, XLogP of 1.72, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-[2-(2-oxo-1H-pyridin-3-yl)propyl]-1H-pyridin-2-one is sourced from PubChem (CID 134461758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).