3-amino-1-cyclopentyl-6-(2,5-dimethylphenyl)pyridin-2-one

C18H22N2O — CID 82466903

IUPAC3-amino-1-cyclopentyl-6-(2,5-dimethylphenyl)pyridin-2-one
SMILESCc1ccc(C)c(-c2ccc(N)c(=O)n2C2CCCC2)c1
InChIInChI=1S/C18H22N2O/c1-12-7-8-13(2)15(11-12)17-10-9-16(19)18(21)20(17)14-5-3-4-6-14/h7-11,14H,3-6,19H2,1-2H3
InChIKeyVGMWSJNQFOYRKV-UHFFFAOYSA-N
MW282.39 g/mol
LogP3.83
Rot. Bonds2

About 3-amino-1-cyclopentyl-6-(2,5-dimethylphenyl)pyridin-2-one

3-amino-1-cyclopentyl-6-(2,5-dimethylphenyl)pyridin-2-one (PubChem CID 82466903) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is 3-amino-1-cyclopentyl-6-(2,5-dimethylphenyl)pyridin-2-one.

Molecular Properties

Compound Name3-amino-1-cyclopentyl-6-(2,5-dimethylphenyl)pyridin-2-one
PubChem CID82466903
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC Name3-amino-1-cyclopentyl-6-(2,5-dimethylphenyl)pyridin-2-one
SMILESCc1ccc(C)c(-c2ccc(N)c(=O)n2C2CCCC2)c1
InChIInChI=1S/C18H22N2O/c1-12-7-8-13(2)15(11-12)17-10-9-16(19)18(21)20(17)14-5-3-4-6-14/h7-11,14H,3-6,19H2,1-2H3
InChIKeyVGMWSJNQFOYRKV-UHFFFAOYSA-N
XLogP3.83
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-1-cyclohexyl-6-(2,4-dimethylphenyl)pyridin-2-one
CID 82466873
3-(aminomethyl)-1-cyclopentyl-6-(2,5-dimethylphenyl)pyridin-2-one
CID 82189364
3-(aminomethyl)-1-cyclopentyl-6-(2,4-dimethylphenyl)pyridin-2-one
CID 82189330
3-amino-1-cyclopentyl-6-(4-fluorophenyl)pyridin-2-one
CID 82466930
3-amino-1-cyclopentyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)pyridin-2-one
CID 82466918
3-amino-1-cyclohexyl-6-(4-propan-2-ylphenyl)pyridin-2-one
CID 82466859
2-(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)-4-methylaniline
CID 61362386
3-amino-1-cyclopropyl-6-(2,5-dichlorophenyl)pyridin-2-one
CID 82466970
3-amino-1-cyclopropyl-6-(4-methoxy-3-methylphenyl)pyridin-2-one
CID 82467193
3-amino-1-cyclopropyl-6-(2-methoxyphenyl)pyridin-2-one
CID 82466975
3-(aminomethyl)-1-cyclohexyl-4-methyl-6-(4-methylphenyl)pyridin-2-one
CID 82189598
3-amino-1,6-di(cyclobutyl)pyridin-2-one
CID 105472759

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-cyclopentyl-6-(2,5-dimethylphenyl)pyridin-2-one?
The IUPAC name of 3-amino-1-cyclopentyl-6-(2,5-dimethylphenyl)pyridin-2-one (CID 82466903) is 3-amino-1-cyclopentyl-6-(2,5-dimethylphenyl)pyridin-2-one.
What is the SMILES notation for 3-amino-1-cyclopentyl-6-(2,5-dimethylphenyl)pyridin-2-one?
The canonical SMILES for 3-amino-1-cyclopentyl-6-(2,5-dimethylphenyl)pyridin-2-one is Cc1ccc(C)c(-c2ccc(N)c(=O)n2C2CCCC2)c1.
What is the InChIKey of 3-amino-1-cyclopentyl-6-(2,5-dimethylphenyl)pyridin-2-one?
The InChIKey is VGMWSJNQFOYRKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O/c1-12-7-8-13(2)15(11-12)17-10-9-16(19)18(21)20(17)14-5-3-4-6-14/h7-11,14H,3-6,19H2,1-2H3.
What are the key properties of 3-amino-1-cyclopentyl-6-(2,5-dimethylphenyl)pyridin-2-one?
3-amino-1-cyclopentyl-6-(2,5-dimethylphenyl)pyridin-2-one has a molecular weight of 282.39 g/mol, XLogP of 3.83, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-cyclopentyl-6-(2,5-dimethylphenyl)pyridin-2-one is sourced from PubChem (CID 82466903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).