1-(2-aminoethyl)-5-phenylpyridin-2-one

C13H14N2O — CID 82113594

IUPAC1-(2-aminoethyl)-5-phenylpyridin-2-one
SMILESNCCn1cc(-c2ccccc2)ccc1=O
InChIInChI=1S/C13H14N2O/c14-8-9-15-10-12(6-7-13(15)16)11-4-2-1-3-5-11/h1-7,10H,8-9,14H2
InChIKeySAQZUWHJMRPKSZ-UHFFFAOYSA-N
MW214.27 g/mol
LogP1.47
Rot. Bonds3

About 1-(2-aminoethyl)-5-phenylpyridin-2-one

1-(2-aminoethyl)-5-phenylpyridin-2-one (PubChem CID 82113594) has the molecular formula C13H14N2O and a molecular weight of 214.27 g/mol. Its IUPAC name is 1-(2-aminoethyl)-5-phenylpyridin-2-one.

Molecular Properties

Compound Name1-(2-aminoethyl)-5-phenylpyridin-2-one
PubChem CID82113594
Molecular FormulaC13H14N2O
Molecular Weight214.27 g/mol
Exact Mass214.11
IUPAC Name1-(2-aminoethyl)-5-phenylpyridin-2-one
SMILESNCCn1cc(-c2ccccc2)ccc1=O
InChIInChI=1S/C13H14N2O/c14-8-9-15-10-12(6-7-13(15)16)11-4-2-1-3-5-11/h1-7,10H,8-9,14H2
InChIKeySAQZUWHJMRPKSZ-UHFFFAOYSA-N
XLogP1.47
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2-aminoethyl)-5-phenylpyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(2-aminoethyl)-5-phenylpyridin-2-one?
The IUPAC name of 1-(2-aminoethyl)-5-phenylpyridin-2-one (CID 82113594) is 1-(2-aminoethyl)-5-phenylpyridin-2-one.
What is the SMILES notation for 1-(2-aminoethyl)-5-phenylpyridin-2-one?
The canonical SMILES for 1-(2-aminoethyl)-5-phenylpyridin-2-one is NCCn1cc(-c2ccccc2)ccc1=O.
What is the InChIKey of 1-(2-aminoethyl)-5-phenylpyridin-2-one?
The InChIKey is SAQZUWHJMRPKSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O/c14-8-9-15-10-12(6-7-13(15)16)11-4-2-1-3-5-11/h1-7,10H,8-9,14H2.
What are the key properties of 1-(2-aminoethyl)-5-phenylpyridin-2-one?
1-(2-aminoethyl)-5-phenylpyridin-2-one has a molecular weight of 214.27 g/mol, XLogP of 1.47, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminoethyl)-5-phenylpyridin-2-one is sourced from PubChem (CID 82113594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).