4-amino-5-methyl-1H-pyridin-2-one

C6H8N2O — CID 13295732

IUPAC4-amino-5-methyl-1H-pyridin-2-one
SMILESCc1c[nH]c(=O)cc1N
InChIInChI=1S/C6H8N2O/c1-4-3-8-6(9)2-5(4)7/h2-3H,1H3,(H3,7,8,9)
InChIKeySSQZBQXJYGNUSC-UHFFFAOYSA-N
MW124.14 g/mol
LogP0.27
Rot. Bonds

About 4-amino-5-methyl-1H-pyridin-2-one

4-amino-5-methyl-1H-pyridin-2-one (PubChem CID 13295732) has the molecular formula C6H8N2O and a molecular weight of 124.14 g/mol. Its IUPAC name is 4-amino-5-methyl-1H-pyridin-2-one.

Molecular Properties

Compound Name4-amino-5-methyl-1H-pyridin-2-one
PubChem CID13295732
Molecular FormulaC6H8N2O
Molecular Weight124.14 g/mol
Exact Mass124.06
IUPAC Name4-amino-5-methyl-1H-pyridin-2-one
SMILESCc1c[nH]c(=O)cc1N
InChIInChI=1S/C6H8N2O/c1-4-3-8-6(9)2-5(4)7/h2-3H,1H3,(H3,7,8,9)
InChIKeySSQZBQXJYGNUSC-UHFFFAOYSA-N
XLogP0.27
TPSA58.88 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.14
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-amino-5-methyl-1H-pyridin-2-one?
The IUPAC name of 4-amino-5-methyl-1H-pyridin-2-one (CID 13295732) is 4-amino-5-methyl-1H-pyridin-2-one.
What is the SMILES notation for 4-amino-5-methyl-1H-pyridin-2-one?
The canonical SMILES for 4-amino-5-methyl-1H-pyridin-2-one is Cc1c[nH]c(=O)cc1N.
What is the InChIKey of 4-amino-5-methyl-1H-pyridin-2-one?
The InChIKey is SSQZBQXJYGNUSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O/c1-4-3-8-6(9)2-5(4)7/h2-3H,1H3,(H3,7,8,9).
What are the key properties of 4-amino-5-methyl-1H-pyridin-2-one?
4-amino-5-methyl-1H-pyridin-2-one has a molecular weight of 124.14 g/mol, XLogP of 0.27, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-methyl-1H-pyridin-2-one is sourced from PubChem (CID 13295732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).