3-amino-1,6-dimethylpyridin-2-one

C7H10N2O — CID 71695441

IUPAC3-amino-1,6-dimethylpyridin-2-one
SMILESCc1ccc(N)c(=O)n1C
InChIInChI=1S/C7H10N2O/c1-5-3-4-6(8)7(10)9(5)2/h3-4H,8H2,1-2H3
InChIKeyVFLVYBUNQQTDOV-UHFFFAOYSA-N
MW138.17 g/mol
LogP0.28
Rot. Bonds

About 3-amino-1,6-dimethylpyridin-2-one

3-amino-1,6-dimethylpyridin-2-one (PubChem CID 71695441) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is 3-amino-1,6-dimethylpyridin-2-one.

Molecular Properties

Compound Name3-amino-1,6-dimethylpyridin-2-one
PubChem CID71695441
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC Name3-amino-1,6-dimethylpyridin-2-one
SMILESCc1ccc(N)c(=O)n1C
InChIInChI=1S/C7H10N2O/c1-5-3-4-6(8)7(10)9(5)2/h3-4H,8H2,1-2H3
InChIKeyVFLVYBUNQQTDOV-UHFFFAOYSA-N
XLogP0.28
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-amino-1,6-dimethylpyridin-2-one?
The IUPAC name of 3-amino-1,6-dimethylpyridin-2-one (CID 71695441) is 3-amino-1,6-dimethylpyridin-2-one.
What is the SMILES notation for 3-amino-1,6-dimethylpyridin-2-one?
The canonical SMILES for 3-amino-1,6-dimethylpyridin-2-one is Cc1ccc(N)c(=O)n1C.
What is the InChIKey of 3-amino-1,6-dimethylpyridin-2-one?
The InChIKey is VFLVYBUNQQTDOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c1-5-3-4-6(8)7(10)9(5)2/h3-4H,8H2,1-2H3.
What are the key properties of 3-amino-1,6-dimethylpyridin-2-one?
3-amino-1,6-dimethylpyridin-2-one has a molecular weight of 138.17 g/mol, XLogP of 0.28, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1,6-dimethylpyridin-2-one is sourced from PubChem (CID 71695441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).