3-(aminomethyl)-6-ethyl-1-phenylpyridin-2-one

C14H16N2O — CID 105485857

IUPAC3-(aminomethyl)-6-ethyl-1-phenylpyridin-2-one
SMILESCCc1ccc(CN)c(=O)n1-c1ccccc1
InChIInChI=1S/C14H16N2O/c1-2-12-9-8-11(10-15)14(17)16(12)13-6-4-3-5-7-13/h3-9H,2,10,15H2,1H3
InChIKeyBRVFJVFTKJVWEO-UHFFFAOYSA-N
MW228.29 g/mol
LogP1.86
Rot. Bonds3

About 3-(aminomethyl)-6-ethyl-1-phenylpyridin-2-one

3-(aminomethyl)-6-ethyl-1-phenylpyridin-2-one (PubChem CID 105485857) has the molecular formula C14H16N2O and a molecular weight of 228.29 g/mol. Its IUPAC name is 3-(aminomethyl)-6-ethyl-1-phenylpyridin-2-one.

Molecular Properties

Compound Name3-(aminomethyl)-6-ethyl-1-phenylpyridin-2-one
PubChem CID105485857
Molecular FormulaC14H16N2O
Molecular Weight228.29 g/mol
Exact Mass228.13
IUPAC Name3-(aminomethyl)-6-ethyl-1-phenylpyridin-2-one
SMILESCCc1ccc(CN)c(=O)n1-c1ccccc1
InChIInChI=1S/C14H16N2O/c1-2-12-9-8-11(10-15)14(17)16(12)13-6-4-3-5-7-13/h3-9H,2,10,15H2,1H3
InChIKeyBRVFJVFTKJVWEO-UHFFFAOYSA-N
XLogP1.86
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

8-[3-(aminomethyl)phenyl]-3-ethyl-2-phenylisoquinolin-1-one
CID 144514912
3-(aminomethyl)-1-(4-methylphenyl)-6-propan-2-ylpyridin-2-one
CID 82189019
3-amino-6-ethyl-1-(4-fluorophenyl)pyridin-2-one
CID 105490770
3-(aminomethyl)-1-ethyl-6-propylpyridin-2-one
CID 105448466
2-ethyl-3-phenylquinazolin-4-one
CID 719985
1-ethyl-4-phenyl-1,2,4-triazolidine-3,5-dione
CID 70937889
8-but-1-ynyl-3-ethyl-2-phenylisoquinolin-1-one
CID 144824176
3-ethyl-N-methyl-1-oxo-2-phenylisoquinoline-8-carboxamide
CID 144514885
8-[4-(aminomethyl)phenyl]-3-ethyl-2-phenylisoquinolin-1-one;[1,3]thiazolo[5,4-d]pyrimidin-7-amine
CID 144514925
4-ethyl-2-phenylpyrimido[1,6-a]quinoline-1,3-dione
CID 2784876
2-ethyl-6-methyl-1,5-diphenylpyrimidin-4-one
CID 776578
5-bromo-1,6-diethyl-3-phenylpyrimidine-2,4-dione
CID 142079218

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-6-ethyl-1-phenylpyridin-2-one?
The IUPAC name of 3-(aminomethyl)-6-ethyl-1-phenylpyridin-2-one (CID 105485857) is 3-(aminomethyl)-6-ethyl-1-phenylpyridin-2-one.
What is the SMILES notation for 3-(aminomethyl)-6-ethyl-1-phenylpyridin-2-one?
The canonical SMILES for 3-(aminomethyl)-6-ethyl-1-phenylpyridin-2-one is CCc1ccc(CN)c(=O)n1-c1ccccc1.
What is the InChIKey of 3-(aminomethyl)-6-ethyl-1-phenylpyridin-2-one?
The InChIKey is BRVFJVFTKJVWEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c1-2-12-9-8-11(10-15)14(17)16(12)13-6-4-3-5-7-13/h3-9H,2,10,15H2,1H3.
What are the key properties of 3-(aminomethyl)-6-ethyl-1-phenylpyridin-2-one?
3-(aminomethyl)-6-ethyl-1-phenylpyridin-2-one has a molecular weight of 228.29 g/mol, XLogP of 1.86, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-6-ethyl-1-phenylpyridin-2-one is sourced from PubChem (CID 105485857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).