3-[(E)-2-phenylethenyl]-1H-quinolin-2-one

C17H13NO — CID 12867118

IUPAC3-[(E)-2-phenylethenyl]-1H-quinolin-2-one
SMILESO=c1[nH]c2ccccc2cc1/C=C/c1ccccc1
InChIInChI=1S/C17H13NO/c19-17-15(11-10-13-6-2-1-3-7-13)12-14-8-4-5-9-16(14)18-17/h1-12H,(H,18,19)/b11-10+
InChIKeyBBPZMADHJXZOJR-ZHACJKMWSA-N
MW247.30 g/mol
LogP3.70
Rot. Bonds2

About 3-[(E)-2-phenylethenyl]-1H-quinolin-2-one

3-[(E)-2-phenylethenyl]-1H-quinolin-2-one (PubChem CID 12867118) has the molecular formula C17H13NO and a molecular weight of 247.30 g/mol. Its IUPAC name is 3-[(E)-2-phenylethenyl]-1H-quinolin-2-one.

Molecular Properties

Compound Name3-[(E)-2-phenylethenyl]-1H-quinolin-2-one
PubChem CID12867118
Molecular FormulaC17H13NO
Molecular Weight247.30 g/mol
Exact Mass247.10
IUPAC Name3-[(E)-2-phenylethenyl]-1H-quinolin-2-one
SMILESO=c1[nH]c2ccccc2cc1/C=C/c1ccccc1
InChIInChI=1S/C17H13NO/c19-17-15(11-10-13-6-2-1-3-7-13)12-14-8-4-5-9-16(14)18-17/h1-12H,(H,18,19)/b11-10+
InChIKeyBBPZMADHJXZOJR-ZHACJKMWSA-N
XLogP3.70
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-[(E)-2-phenylethenyl]-1H-quinolin-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

Related Compounds

3-[3-(2,6-dimethoxyphenyl)-3-oxoprop-1-enyl]-1H-quinolin-2-one
CID 135339943
3-[(E)-3-[4-(dimethylamino)phenyl]-3-oxoprop-1-enyl]-1H-quinolin-2-one
CID 34904119
3-nitroso-1H-quinolin-2-one
CID 22103970
4-[(E)-3-(2-oxo-1H-quinolin-3-yl)prop-2-enoyl]piperazine-1-carbaldehyde
CID 110408570
(E)-N-(2-fluorophenyl)-3-(2-oxo-1H-quinolin-3-yl)prop-2-enamide
CID 110420245
3-[(E)-3-morpholin-4-yl-3-oxoprop-1-enyl]-1H-quinolin-2-one
CID 110407799
3-(18F)fluoro-1H-quinolin-2-one
CID 158117840
3-hydroxy-1H-quinolin-2-one
CID 162237175
3-hydroxy-1H-quinolin-2-one
CID 818159
(E)-N-(3-acetamidophenyl)-3-(2-oxo-1H-quinolin-3-yl)prop-2-enamide
CID 110423772
(E)-N-(3,4-difluorophenyl)-3-(2-oxo-1H-quinolin-3-yl)prop-2-enamide
CID 110428944
copper bis(2-oxo-1H-quinolin-3-olate)
CID 67199859

Frequently Asked Questions

What is the IUPAC name of 3-[(E)-2-phenylethenyl]-1H-quinolin-2-one?
The IUPAC name of 3-[(E)-2-phenylethenyl]-1H-quinolin-2-one (CID 12867118) is 3-[(E)-2-phenylethenyl]-1H-quinolin-2-one.
What is the SMILES notation for 3-[(E)-2-phenylethenyl]-1H-quinolin-2-one?
The canonical SMILES for 3-[(E)-2-phenylethenyl]-1H-quinolin-2-one is O=c1[nH]c2ccccc2cc1/C=C/c1ccccc1.
What is the InChIKey of 3-[(E)-2-phenylethenyl]-1H-quinolin-2-one?
The InChIKey is BBPZMADHJXZOJR-ZHACJKMWSA-N. The full InChI is InChI=1S/C17H13NO/c19-17-15(11-10-13-6-2-1-3-7-13)12-14-8-4-5-9-16(14)18-17/h1-12H,(H,18,19)/b11-10+.
What are the key properties of 3-[(E)-2-phenylethenyl]-1H-quinolin-2-one?
3-[(E)-2-phenylethenyl]-1H-quinolin-2-one has a molecular weight of 247.30 g/mol, XLogP of 3.70, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(E)-2-phenylethenyl]-1H-quinolin-2-one is sourced from PubChem (CID 12867118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).