4-amino-1-methyl-6-(4-methylphenyl)pyridin-2-one

C13H14N2O — CID 105467816

IUPAC4-amino-1-methyl-6-(4-methylphenyl)pyridin-2-one
SMILESCc1ccc(-c2cc(N)cc(=O)n2C)cc1
InChIInChI=1S/C13H14N2O/c1-9-3-5-10(6-4-9)12-7-11(14)8-13(16)15(12)2/h3-8H,14H2,1-2H3
InChIKeyJYHQHCLITSLMSS-UHFFFAOYSA-N
MW214.27 g/mol
LogP1.94
Rot. Bonds1

About 4-amino-1-methyl-6-(4-methylphenyl)pyridin-2-one

4-amino-1-methyl-6-(4-methylphenyl)pyridin-2-one (PubChem CID 105467816) has the molecular formula C13H14N2O and a molecular weight of 214.27 g/mol. Its IUPAC name is 4-amino-1-methyl-6-(4-methylphenyl)pyridin-2-one.

Molecular Properties

Compound Name4-amino-1-methyl-6-(4-methylphenyl)pyridin-2-one
PubChem CID105467816
Molecular FormulaC13H14N2O
Molecular Weight214.27 g/mol
Exact Mass214.11
IUPAC Name4-amino-1-methyl-6-(4-methylphenyl)pyridin-2-one
SMILESCc1ccc(-c2cc(N)cc(=O)n2C)cc1
InChIInChI=1S/C13H14N2O/c1-9-3-5-10(6-4-9)12-7-11(14)8-13(16)15(12)2/h3-8H,14H2,1-2H3
InChIKeyJYHQHCLITSLMSS-UHFFFAOYSA-N
XLogP1.94
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-amino-1-methyl-6-(4-methylphenyl)pyridin-2-one?
The IUPAC name of 4-amino-1-methyl-6-(4-methylphenyl)pyridin-2-one (CID 105467816) is 4-amino-1-methyl-6-(4-methylphenyl)pyridin-2-one.
What is the SMILES notation for 4-amino-1-methyl-6-(4-methylphenyl)pyridin-2-one?
The canonical SMILES for 4-amino-1-methyl-6-(4-methylphenyl)pyridin-2-one is Cc1ccc(-c2cc(N)cc(=O)n2C)cc1.
What is the InChIKey of 4-amino-1-methyl-6-(4-methylphenyl)pyridin-2-one?
The InChIKey is JYHQHCLITSLMSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O/c1-9-3-5-10(6-4-9)12-7-11(14)8-13(16)15(12)2/h3-8H,14H2,1-2H3.
What are the key properties of 4-amino-1-methyl-6-(4-methylphenyl)pyridin-2-one?
4-amino-1-methyl-6-(4-methylphenyl)pyridin-2-one has a molecular weight of 214.27 g/mol, XLogP of 1.94, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-methyl-6-(4-methylphenyl)pyridin-2-one is sourced from PubChem (CID 105467816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).