3-amino-1-cyclohexyl-6-(4-propan-2-ylphenyl)pyridin-2-one

C20H26N2O — CID 82466859

IUPAC3-amino-1-cyclohexyl-6-(4-propan-2-ylphenyl)pyridin-2-one
SMILESCC(C)c1ccc(-c2ccc(N)c(=O)n2C2CCCCC2)cc1
InChIInChI=1S/C20H26N2O/c1-14(2)15-8-10-16(11-9-15)19-13-12-18(21)20(23)22(19)17-6-4-3-5-7-17/h8-14,17H,3-7,21H2,1-2H3
InChIKeyLACOANFLYUABFS-UHFFFAOYSA-N
MW310.44 g/mol
LogP4.73
Rot. Bonds3

About 3-amino-1-cyclohexyl-6-(4-propan-2-ylphenyl)pyridin-2-one

3-amino-1-cyclohexyl-6-(4-propan-2-ylphenyl)pyridin-2-one (PubChem CID 82466859) has the molecular formula C20H26N2O and a molecular weight of 310.44 g/mol. Its IUPAC name is 3-amino-1-cyclohexyl-6-(4-propan-2-ylphenyl)pyridin-2-one.

Molecular Properties

Compound Name3-amino-1-cyclohexyl-6-(4-propan-2-ylphenyl)pyridin-2-one
PubChem CID82466859
Molecular FormulaC20H26N2O
Molecular Weight310.44 g/mol
Exact Mass310.20
IUPAC Name3-amino-1-cyclohexyl-6-(4-propan-2-ylphenyl)pyridin-2-one
SMILESCC(C)c1ccc(-c2ccc(N)c(=O)n2C2CCCCC2)cc1
InChIInChI=1S/C20H26N2O/c1-14(2)15-8-10-16(11-9-15)19-13-12-18(21)20(23)22(19)17-6-4-3-5-7-17/h8-14,17H,3-7,21H2,1-2H3
InChIKeyLACOANFLYUABFS-UHFFFAOYSA-N
XLogP4.73
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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
1-cyclopropyl-2-oxo-6-(4-propan-2-ylphenyl)pyridine-3-carboximidamide
CID 82520398
2-[1-cyclopropyl-2-oxo-6-(4-propan-2-ylphenyl)-3-pyridinyl]acetonitrile
CID 82520396
3-amino-1-cyclohexyl-6-(2,4-dimethylphenyl)pyridin-2-one
CID 82466873
3-amino-1-cyclopentyl-6-(2,5-dimethylphenyl)pyridin-2-one
CID 82466903
3-amino-1-cyclopropyl-6-(4-methoxy-3-methylphenyl)pyridin-2-one
CID 82467193
3-(aminomethyl)-1-cyclohexyl-4-methyl-6-(4-methylphenyl)pyridin-2-one
CID 82189598
5-amino-1-cyclohexyl-6-methylpyridin-2-one
CID 165473593
3-amino-1,6-di(cyclobutyl)pyridin-2-one
CID 105472759
3-acetyl-1-cyclopentyl-6-(4-fluorophenyl)pyridin-2-one
CID 82519443
3-amino-1-cyclopropyl-6-(2,5-dichlorophenyl)pyridin-2-one
CID 82466970

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-cyclohexyl-6-(4-propan-2-ylphenyl)pyridin-2-one?
The IUPAC name of 3-amino-1-cyclohexyl-6-(4-propan-2-ylphenyl)pyridin-2-one (CID 82466859) is 3-amino-1-cyclohexyl-6-(4-propan-2-ylphenyl)pyridin-2-one.
What is the SMILES notation for 3-amino-1-cyclohexyl-6-(4-propan-2-ylphenyl)pyridin-2-one?
The canonical SMILES for 3-amino-1-cyclohexyl-6-(4-propan-2-ylphenyl)pyridin-2-one is CC(C)c1ccc(-c2ccc(N)c(=O)n2C2CCCCC2)cc1.
What is the InChIKey of 3-amino-1-cyclohexyl-6-(4-propan-2-ylphenyl)pyridin-2-one?
The InChIKey is LACOANFLYUABFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O/c1-14(2)15-8-10-16(11-9-15)19-13-12-18(21)20(23)22(19)17-6-4-3-5-7-17/h8-14,17H,3-7,21H2,1-2H3.
What are the key properties of 3-amino-1-cyclohexyl-6-(4-propan-2-ylphenyl)pyridin-2-one?
3-amino-1-cyclohexyl-6-(4-propan-2-ylphenyl)pyridin-2-one has a molecular weight of 310.44 g/mol, XLogP of 4.73, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-cyclohexyl-6-(4-propan-2-ylphenyl)pyridin-2-one is sourced from PubChem (CID 82466859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).