3-(3-ethylphenyl)-1H-pyridin-2-one

C13H13NO — CID 57202866

IUPAC3-(3-ethylphenyl)-1H-pyridin-2-one
SMILESCCc1cccc(-c2ccc[nH]c2=O)c1
InChIInChI=1S/C13H13NO/c1-2-10-5-3-6-11(9-10)12-7-4-8-14-13(12)15/h3-9H,2H2,1H3,(H,14,15)
InChIKeyOLJFYRMPSUUUKR-UHFFFAOYSA-N
MW199.25 g/mol
LogP2.60
Rot. Bonds2

About 3-(3-ethylphenyl)-1H-pyridin-2-one

3-(3-ethylphenyl)-1H-pyridin-2-one (PubChem CID 57202866) has the molecular formula C13H13NO and a molecular weight of 199.25 g/mol. Its IUPAC name is 3-(3-ethylphenyl)-1H-pyridin-2-one.

Molecular Properties

Compound Name3-(3-ethylphenyl)-1H-pyridin-2-one
PubChem CID57202866
Molecular FormulaC13H13NO
Molecular Weight199.25 g/mol
Exact Mass199.10
IUPAC Name3-(3-ethylphenyl)-1H-pyridin-2-one
SMILESCCc1cccc(-c2ccc[nH]c2=O)c1
InChIInChI=1S/C13H13NO/c1-2-10-5-3-6-11(9-10)12-7-4-8-14-13(12)15/h3-9H,2H2,1H3,(H,14,15)
InChIKeyOLJFYRMPSUUUKR-UHFFFAOYSA-N
XLogP2.60
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-(3-ethylphenyl)-1H-pyridin-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-ethoxyphenyl)-1H-pyridin-2-one
CID 53217766
1,4-diethyl-2-(3-ethylphenyl)benzene
CID 102240202
3-(3-fluoro-4-methylphenyl)-1H-pyridin-2-one
CID 53217607
4-(3-ethylphenyl)-5-propan-2-yl-1H-pyrimidin-6-one
CID 136955633
2-[2-(3-ethylphenyl)phenyl]acetaldehyde
CID 87253918
1-ethyl-3-(3-ethylphenyl)benzene;methanediamine
CID 134305122
N-[[3-[7-tert-butyl-5-(2-oxo-1H-pyridin-3-yl)-1-benzofuran-3-yl]phenyl]methyl]methanesulfonamide
CID 45138943
1-bromo-4-ethyl-2-(3-ethylphenyl)benzene
CID 142855411
3-ethyl-6-(3-ethylphenyl)benzene-1,2-diol
CID 101302583
2,3-diethyl-4-(3-ethylphenyl)phenol
CID 101302434
1-ethyl-3-phenylbenzene;propane
CID 145466525
methyl 2-fluoro-5-(2-oxo-1H-pyridin-3-yl)benzoate
CID 53218107

Frequently Asked Questions

What is the IUPAC name of 3-(3-ethylphenyl)-1H-pyridin-2-one?
The IUPAC name of 3-(3-ethylphenyl)-1H-pyridin-2-one (CID 57202866) is 3-(3-ethylphenyl)-1H-pyridin-2-one.
What is the SMILES notation for 3-(3-ethylphenyl)-1H-pyridin-2-one?
The canonical SMILES for 3-(3-ethylphenyl)-1H-pyridin-2-one is CCc1cccc(-c2ccc[nH]c2=O)c1.
What is the InChIKey of 3-(3-ethylphenyl)-1H-pyridin-2-one?
The InChIKey is OLJFYRMPSUUUKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO/c1-2-10-5-3-6-11(9-10)12-7-4-8-14-13(12)15/h3-9H,2H2,1H3,(H,14,15).
What are the key properties of 3-(3-ethylphenyl)-1H-pyridin-2-one?
3-(3-ethylphenyl)-1H-pyridin-2-one has a molecular weight of 199.25 g/mol, XLogP of 2.60, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-ethylphenyl)-1H-pyridin-2-one is sourced from PubChem (CID 57202866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).