3-(aminomethyl)-6-methyl-1-(pyridin-2-ylmethyl)pyridin-2-one

C13H15N3O — CID 107073142

IUPAC3-(aminomethyl)-6-methyl-1-(pyridin-2-ylmethyl)pyridin-2-one
SMILESCc1ccc(CN)c(=O)n1Cc1ccccn1
InChIInChI=1S/C13H15N3O/c1-10-5-6-11(8-14)13(17)16(10)9-12-4-2-3-7-15-12/h2-7H,8-9,14H2,1H3
InChIKeyPKRJWUZKJUDQSV-UHFFFAOYSA-N
MW229.28 g/mol
LogP1.06
Rot. Bonds3

About 3-(aminomethyl)-6-methyl-1-(pyridin-2-ylmethyl)pyridin-2-one

3-(aminomethyl)-6-methyl-1-(pyridin-2-ylmethyl)pyridin-2-one (PubChem CID 107073142) has the molecular formula C13H15N3O and a molecular weight of 229.28 g/mol. Its IUPAC name is 3-(aminomethyl)-6-methyl-1-(pyridin-2-ylmethyl)pyridin-2-one.

Molecular Properties

Compound Name3-(aminomethyl)-6-methyl-1-(pyridin-2-ylmethyl)pyridin-2-one
PubChem CID107073142
Molecular FormulaC13H15N3O
Molecular Weight229.28 g/mol
Exact Mass229.12
IUPAC Name3-(aminomethyl)-6-methyl-1-(pyridin-2-ylmethyl)pyridin-2-one
SMILESCc1ccc(CN)c(=O)n1Cc1ccccn1
InChIInChI=1S/C13H15N3O/c1-10-5-6-11(8-14)13(17)16(10)9-12-4-2-3-7-15-12/h2-7H,8-9,14H2,1H3
InChIKeyPKRJWUZKJUDQSV-UHFFFAOYSA-N
XLogP1.06
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-amino-1-methyl-3-(pyridin-2-ylmethyl)pyrimidine-2,4-dione
CID 55240714
ethane;pyridin-2-ylmethanamine
CID 90791011
[4-(aminomethyl)-2,3-bis(pyridin-2-ylmethyl)phenyl]methanamine
CID 68592017
[1-(pyridin-2-ylmethyl)-1,2,4-triazol-3-yl]methanamine
CID 62949782
ethane;6-fluoro-2-methyl-3-(pyridin-2-ylmethyl)quinazolin-4-one
CID 145212635
3-(pyridin-2-ylmethyl)-[1,3]oxazolo[4,5-b]pyridin-2-one
CID 75509161
[5-methyl-1-(pyridin-2-ylmethyl)triazol-4-yl]methanamine
CID 82506565
2-[(3,5-dimethylpyrazol-1-yl)methyl]pyridine
CID 12988154
5,11-bis(pyridin-2-ylmethyl)indolo[3,2-b]carbazole
CID 102503171
2-(4-methoxyphenyl)-3-(pyridin-2-ylmethyl)pyrimidin-4-one
CID 155932622
[2-methyl-6-oxo-1-(pyridin-2-ylmethyl)-4-pyridinyl] fluoromethanesulfonate
CID 174471440
methyl 5-methyl-2-propyl-1-(pyridin-2-ylmethyl)pyrrole-3-carboxylate
CID 11608760

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-6-methyl-1-(pyridin-2-ylmethyl)pyridin-2-one?
The IUPAC name of 3-(aminomethyl)-6-methyl-1-(pyridin-2-ylmethyl)pyridin-2-one (CID 107073142) is 3-(aminomethyl)-6-methyl-1-(pyridin-2-ylmethyl)pyridin-2-one.
What is the SMILES notation for 3-(aminomethyl)-6-methyl-1-(pyridin-2-ylmethyl)pyridin-2-one?
The canonical SMILES for 3-(aminomethyl)-6-methyl-1-(pyridin-2-ylmethyl)pyridin-2-one is Cc1ccc(CN)c(=O)n1Cc1ccccn1.
What is the InChIKey of 3-(aminomethyl)-6-methyl-1-(pyridin-2-ylmethyl)pyridin-2-one?
The InChIKey is PKRJWUZKJUDQSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O/c1-10-5-6-11(8-14)13(17)16(10)9-12-4-2-3-7-15-12/h2-7H,8-9,14H2,1H3.
What are the key properties of 3-(aminomethyl)-6-methyl-1-(pyridin-2-ylmethyl)pyridin-2-one?
3-(aminomethyl)-6-methyl-1-(pyridin-2-ylmethyl)pyridin-2-one has a molecular weight of 229.28 g/mol, XLogP of 1.06, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-6-methyl-1-(pyridin-2-ylmethyl)pyridin-2-one is sourced from PubChem (CID 107073142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).