1-(cyclopropylmethyl)-6-propan-2-ylpyridin-2-one

C12H17NO — CID 156528931

IUPAC1-(cyclopropylmethyl)-6-propan-2-ylpyridin-2-one
SMILESCC(C)c1cccc(=O)n1CC1CC1
InChIInChI=1S/C12H17NO/c1-9(2)11-4-3-5-12(14)13(11)8-10-6-7-10/h3-5,9-10H,6-8H2,1-2H3
InChIKeyBFBGBUIBKLPIAT-UHFFFAOYSA-N
MW191.27 g/mol
LogP2.38
Rot. Bonds3

About 1-(cyclopropylmethyl)-6-propan-2-ylpyridin-2-one

1-(cyclopropylmethyl)-6-propan-2-ylpyridin-2-one (PubChem CID 156528931) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)-6-propan-2-ylpyridin-2-one.

Molecular Properties

Compound Name1-(cyclopropylmethyl)-6-propan-2-ylpyridin-2-one
PubChem CID156528931
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name1-(cyclopropylmethyl)-6-propan-2-ylpyridin-2-one
SMILESCC(C)c1cccc(=O)n1CC1CC1
InChIInChI=1S/C12H17NO/c1-9(2)11-4-3-5-12(14)13(11)8-10-6-7-10/h3-5,9-10H,6-8H2,1-2H3
InChIKeyBFBGBUIBKLPIAT-UHFFFAOYSA-N
XLogP2.38
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-(cyclopropylmethyl)-6-propan-2-ylpyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(cyclopropylmethyl)-2-phenyl-5-propan-2-ylpyrrole;methane
CID 158001195
1-(cyclopropylmethyl)-2-[(E)-2-phenylethenyl]-5-propan-2-ylpyrrole
CID 156528698
2-oxo-1-(piperidin-4-ylmethyl)-6-propan-2-ylpyridine-3-carbonitrile
CID 82147177
2-(cyclopropylmethyl)pyridazin-3-one
CID 72682825
6-chloro-1-[(1-methylsulfonylpyrrolidin-3-yl)methyl]pyridin-2-one
CID 122155284
1-[(4-aminocyclohexyl)methyl]-3-methylbenzimidazol-2-one
CID 67339990
6-chloro-3-(cyclobutylmethyl)-2-propan-2-ylpyrimidin-4-one
CID 114584988
5-tert-butyl-1-(cyclopropylmethyl)pyridin-2-one
CID 134553560
1-(cyclopropylmethyl)-2-methyl-5-phenylpyrrole
CID 130382198
3-(cyclopropylmethyl)-1-methylquinazoline-2,4-dione
CID 90714195
3-(oxan-4-ylmethyl)-1-phenylpyrimidine-2,4-dione
CID 167439165
3-[1-(cyclopentylmethyl)indol-2-yl]butanoic acid
CID 117119019

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethyl)-6-propan-2-ylpyridin-2-one?
The IUPAC name of 1-(cyclopropylmethyl)-6-propan-2-ylpyridin-2-one (CID 156528931) is 1-(cyclopropylmethyl)-6-propan-2-ylpyridin-2-one.
What is the SMILES notation for 1-(cyclopropylmethyl)-6-propan-2-ylpyridin-2-one?
The canonical SMILES for 1-(cyclopropylmethyl)-6-propan-2-ylpyridin-2-one is CC(C)c1cccc(=O)n1CC1CC1.
What is the InChIKey of 1-(cyclopropylmethyl)-6-propan-2-ylpyridin-2-one?
The InChIKey is BFBGBUIBKLPIAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c1-9(2)11-4-3-5-12(14)13(11)8-10-6-7-10/h3-5,9-10H,6-8H2,1-2H3.
What are the key properties of 1-(cyclopropylmethyl)-6-propan-2-ylpyridin-2-one?
1-(cyclopropylmethyl)-6-propan-2-ylpyridin-2-one has a molecular weight of 191.27 g/mol, XLogP of 2.38, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethyl)-6-propan-2-ylpyridin-2-one is sourced from PubChem (CID 156528931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).