3-amino-6-methyl-3H-pyridin-2-one

C6H8N2O — CID 72746119

IUPAC3-amino-6-methyl-3H-pyridin-2-one
SMILESCC1=NC(=O)C(N)C=C1
InChIInChI=1S/C6H8N2O/c1-4-2-3-5(7)6(9)8-4/h2-3,5H,7H2,1H3
InChIKeyYSAFIIPUPITHGN-UHFFFAOYSA-N
MW124.14 g/mol
LogP-0.13
Rot. Bonds

About 3-amino-6-methyl-3H-pyridin-2-one

3-amino-6-methyl-3H-pyridin-2-one (PubChem CID 72746119) has the molecular formula C6H8N2O and a molecular weight of 124.14 g/mol. Its IUPAC name is 3-amino-6-methyl-3H-pyridin-2-one.

Molecular Properties

Compound Name3-amino-6-methyl-3H-pyridin-2-one
PubChem CID72746119
Molecular FormulaC6H8N2O
Molecular Weight124.14 g/mol
Exact Mass124.06
IUPAC Name3-amino-6-methyl-3H-pyridin-2-one
SMILESCC1=NC(=O)C(N)C=C1
InChIInChI=1S/C6H8N2O/c1-4-2-3-5(7)6(9)8-4/h2-3,5H,7H2,1H3
InChIKeyYSAFIIPUPITHGN-UHFFFAOYSA-N
XLogP-0.13
TPSA55.45 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.14
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-amino-6-methyl-3H-pyridin-2-one?
The IUPAC name of 3-amino-6-methyl-3H-pyridin-2-one (CID 72746119) is 3-amino-6-methyl-3H-pyridin-2-one.
What is the SMILES notation for 3-amino-6-methyl-3H-pyridin-2-one?
The canonical SMILES for 3-amino-6-methyl-3H-pyridin-2-one is CC1=NC(=O)C(N)C=C1.
What is the InChIKey of 3-amino-6-methyl-3H-pyridin-2-one?
The InChIKey is YSAFIIPUPITHGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O/c1-4-2-3-5(7)6(9)8-4/h2-3,5H,7H2,1H3.
What are the key properties of 3-amino-6-methyl-3H-pyridin-2-one?
3-amino-6-methyl-3H-pyridin-2-one has a molecular weight of 124.14 g/mol, XLogP of -0.13, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-methyl-3H-pyridin-2-one is sourced from PubChem (CID 72746119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).