6-(aminomethyl)-5-methyl-1H-pyridin-2-one

C7H10N2O — CID 67876131

IUPAC6-(aminomethyl)-5-methyl-1H-pyridin-2-one
SMILESCc1ccc(=O)[nH]c1CN
InChIInChI=1S/C7H10N2O/c1-5-2-3-7(10)9-6(5)4-8/h2-3H,4,8H2,1H3,(H,9,10)
InChIKeyTYJUSWMDFNWLOD-UHFFFAOYSA-N
MW138.17 g/mol
LogP0.14
Rot. Bonds1

About 6-(aminomethyl)-5-methyl-1H-pyridin-2-one

6-(aminomethyl)-5-methyl-1H-pyridin-2-one (PubChem CID 67876131) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is 6-(aminomethyl)-5-methyl-1H-pyridin-2-one.

Molecular Properties

Compound Name6-(aminomethyl)-5-methyl-1H-pyridin-2-one
PubChem CID67876131
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC Name6-(aminomethyl)-5-methyl-1H-pyridin-2-one
SMILESCc1ccc(=O)[nH]c1CN
InChIInChI=1S/C7H10N2O/c1-5-2-3-7(10)9-6(5)4-8/h2-3H,4,8H2,1H3,(H,9,10)
InChIKeyTYJUSWMDFNWLOD-UHFFFAOYSA-N
XLogP0.14
TPSA58.88 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(aminomethyl)-5-methyl-1H-pyridin-2-one?
The IUPAC name of 6-(aminomethyl)-5-methyl-1H-pyridin-2-one (CID 67876131) is 6-(aminomethyl)-5-methyl-1H-pyridin-2-one.
What is the SMILES notation for 6-(aminomethyl)-5-methyl-1H-pyridin-2-one?
The canonical SMILES for 6-(aminomethyl)-5-methyl-1H-pyridin-2-one is Cc1ccc(=O)[nH]c1CN.
What is the InChIKey of 6-(aminomethyl)-5-methyl-1H-pyridin-2-one?
The InChIKey is TYJUSWMDFNWLOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c1-5-2-3-7(10)9-6(5)4-8/h2-3H,4,8H2,1H3,(H,9,10).
What are the key properties of 6-(aminomethyl)-5-methyl-1H-pyridin-2-one?
6-(aminomethyl)-5-methyl-1H-pyridin-2-one has a molecular weight of 138.17 g/mol, XLogP of 0.14, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)-5-methyl-1H-pyridin-2-one is sourced from PubChem (CID 67876131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).