1-methyl-5-[(3-methylcyclohexyl)amino]pyridin-2-one

C13H20N2O — CID 60932533

IUPAC1-methyl-5-[(3-methylcyclohexyl)amino]pyridin-2-one
SMILESCC1CCCC(Nc2ccc(=O)n(C)c2)C1
InChIInChI=1S/C13H20N2O/c1-10-4-3-5-11(8-10)14-12-6-7-13(16)15(2)9-12/h6-7,9-11,14H,3-5,8H2,1-2H3
InChIKeyOHZHHYRRLKKQBS-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.38
Rot. Bonds2

About 1-methyl-5-[(3-methylcyclohexyl)amino]pyridin-2-one

1-methyl-5-[(3-methylcyclohexyl)amino]pyridin-2-one (PubChem CID 60932533) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 1-methyl-5-[(3-methylcyclohexyl)amino]pyridin-2-one.

Molecular Properties

Compound Name1-methyl-5-[(3-methylcyclohexyl)amino]pyridin-2-one
PubChem CID60932533
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name1-methyl-5-[(3-methylcyclohexyl)amino]pyridin-2-one
SMILESCC1CCCC(Nc2ccc(=O)n(C)c2)C1
InChIInChI=1S/C13H20N2O/c1-10-4-3-5-11(8-10)14-12-6-7-13(16)15(2)9-12/h6-7,9-11,14H,3-5,8H2,1-2H3
InChIKeyOHZHHYRRLKKQBS-UHFFFAOYSA-N
XLogP2.38
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-5-[(3-methylcyclobutyl)amino]pyridin-2-one
CID 103561708
5-(cyclohexylamino)-1-methylpyridin-2-one
CID 50988993
1-methyl-5-[[3-(2-methylpropyl)cyclohexyl]amino]pyridin-2-one
CID 107428313
1-methyl-5-(piperidin-4-ylamino)pyridin-2-one
CID 61020667
1-methyl-5-[(5-methylthiolan-3-yl)amino]pyridin-2-one
CID 79950791
4-N-(3-methylcyclohexyl)benzene-1,4-diamine
CID 43317797
4-fluoro-N-(3-methylcyclohexyl)aniline
CID 43097581
1-methyl-5-[(1-propan-2-ylpiperidin-4-yl)amino]pyridin-2-one
CID 54866098
5-[(4-methylcycloheptyl)amino]-1-propylpyridin-2-one
CID 65080429
4-tert-butyl-N-(3-methylcyclohexyl)aniline
CID 43099749
1-methyl-5-[[3-(4-methylphenyl)cyclobutyl]amino]pyridin-2-one
CID 60931916
5-[[3-(4-chlorophenyl)cyclobutyl]amino]-1-methylpyridin-2-one
CID 60932166

Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-[(3-methylcyclohexyl)amino]pyridin-2-one?
The IUPAC name of 1-methyl-5-[(3-methylcyclohexyl)amino]pyridin-2-one (CID 60932533) is 1-methyl-5-[(3-methylcyclohexyl)amino]pyridin-2-one.
What is the SMILES notation for 1-methyl-5-[(3-methylcyclohexyl)amino]pyridin-2-one?
The canonical SMILES for 1-methyl-5-[(3-methylcyclohexyl)amino]pyridin-2-one is CC1CCCC(Nc2ccc(=O)n(C)c2)C1.
What is the InChIKey of 1-methyl-5-[(3-methylcyclohexyl)amino]pyridin-2-one?
The InChIKey is OHZHHYRRLKKQBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-10-4-3-5-11(8-10)14-12-6-7-13(16)15(2)9-12/h6-7,9-11,14H,3-5,8H2,1-2H3.
What are the key properties of 1-methyl-5-[(3-methylcyclohexyl)amino]pyridin-2-one?
1-methyl-5-[(3-methylcyclohexyl)amino]pyridin-2-one has a molecular weight of 220.32 g/mol, XLogP of 2.38, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-[(3-methylcyclohexyl)amino]pyridin-2-one is sourced from PubChem (CID 60932533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).