3-(aminomethyl)-1-(4-methoxyphenyl)pyridin-2-one

C13H14N2O2 — CID 82188928

IUPAC3-(aminomethyl)-1-(4-methoxyphenyl)pyridin-2-one
SMILESCOc1ccc(-n2cccc(CN)c2=O)cc1
InChIInChI=1S/C13H14N2O2/c1-17-12-6-4-11(5-7-12)15-8-2-3-10(9-14)13(15)16/h2-8H,9,14H2,1H3
InChIKeySPQLURSFUQMBSN-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.30
Rot. Bonds3

About 3-(aminomethyl)-1-(4-methoxyphenyl)pyridin-2-one

3-(aminomethyl)-1-(4-methoxyphenyl)pyridin-2-one (PubChem CID 82188928) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is 3-(aminomethyl)-1-(4-methoxyphenyl)pyridin-2-one.

Molecular Properties

Compound Name3-(aminomethyl)-1-(4-methoxyphenyl)pyridin-2-one
PubChem CID82188928
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC Name3-(aminomethyl)-1-(4-methoxyphenyl)pyridin-2-one
SMILESCOc1ccc(-n2cccc(CN)c2=O)cc1
InChIInChI=1S/C13H14N2O2/c1-17-12-6-4-11(5-7-12)15-8-2-3-10(9-14)13(15)16/h2-8H,9,14H2,1H3
InChIKeySPQLURSFUQMBSN-UHFFFAOYSA-N
XLogP1.30
TPSA57.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(aminomethyl)-1-(4-chlorophenyl)pyridin-2-one
CID 105495531
3-(aminomethyl)-1-(4-hydroxyphenyl)pyridin-2-one
CID 105469670
3-(aminomethyl)-6-(3-methoxyphenyl)-1-methylpyridin-2-one
CID 82189410
4-amino-1-(4-methoxyphenyl)pyridin-2-one
CID 10130616
3-[(2-chlorophenyl)methylamino]-1-(4-methoxyphenyl)pyrazin-2-one
CID 20941631
3-amino-4-(4-methoxyphenyl)-1-phenylpyridin-2-one
CID 141318946
1-(4-methoxyphenyl)-2-pentylpyrrole
CID 86037398
1-(4-fluorophenyl)-3-(2-methylpropyl)pyridin-2-one
CID 158427364
2-[4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]ethanamine
CID 56706277
2-[3-(aminomethyl)-2-oxo-1-pyridinyl]-N-(3-methoxyphenyl)acetamide
CID 107017585
[2-[(4-methoxyphenyl)methyl]imidazo[1,2-a]pyridin-8-yl]methanamine
CID 82223273
[5-bromo-1-(4-methoxyphenyl)pyrazol-4-yl]methanamine
CID 115051853

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-1-(4-methoxyphenyl)pyridin-2-one?
The IUPAC name of 3-(aminomethyl)-1-(4-methoxyphenyl)pyridin-2-one (CID 82188928) is 3-(aminomethyl)-1-(4-methoxyphenyl)pyridin-2-one.
What is the SMILES notation for 3-(aminomethyl)-1-(4-methoxyphenyl)pyridin-2-one?
The canonical SMILES for 3-(aminomethyl)-1-(4-methoxyphenyl)pyridin-2-one is COc1ccc(-n2cccc(CN)c2=O)cc1.
What is the InChIKey of 3-(aminomethyl)-1-(4-methoxyphenyl)pyridin-2-one?
The InChIKey is SPQLURSFUQMBSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c1-17-12-6-4-11(5-7-12)15-8-2-3-10(9-14)13(15)16/h2-8H,9,14H2,1H3.
What are the key properties of 3-(aminomethyl)-1-(4-methoxyphenyl)pyridin-2-one?
3-(aminomethyl)-1-(4-methoxyphenyl)pyridin-2-one has a molecular weight of 230.27 g/mol, XLogP of 1.30, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-1-(4-methoxyphenyl)pyridin-2-one is sourced from PubChem (CID 82188928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).