1-[6-(2-phenylethyl)-2-pyridinyl]ethanone

C15H15NO — CID 102432683

IUPAC1-[6-(2-phenylethyl)-2-pyridinyl]ethanone
SMILESCC(=O)c1cccc(CCc2ccccc2)n1
InChIInChI=1S/C15H15NO/c1-12(17)15-9-5-8-14(16-15)11-10-13-6-3-2-4-7-13/h2-9H,10-11H2,1H3
InChIKeyUKGOJGZEGSBGQW-UHFFFAOYSA-N
MW225.29 g/mol
LogP3.07
Rot. Bonds4

About 1-[6-(2-phenylethyl)-2-pyridinyl]ethanone

1-[6-(2-phenylethyl)-2-pyridinyl]ethanone (PubChem CID 102432683) has the molecular formula C15H15NO and a molecular weight of 225.29 g/mol. Its IUPAC name is 1-[6-(2-phenylethyl)-2-pyridinyl]ethanone.

Molecular Properties

Compound Name1-[6-(2-phenylethyl)-2-pyridinyl]ethanone
PubChem CID102432683
Molecular FormulaC15H15NO
Molecular Weight225.29 g/mol
Exact Mass225.12
IUPAC Name1-[6-(2-phenylethyl)-2-pyridinyl]ethanone
SMILESCC(=O)c1cccc(CCc2ccccc2)n1
InChIInChI=1S/C15H15NO/c1-12(17)15-9-5-8-14(16-15)11-10-13-6-3-2-4-7-13/h2-9H,10-11H2,1H3
InChIKeyUKGOJGZEGSBGQW-UHFFFAOYSA-N
XLogP3.07
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-[6-(2-phenylethyl)-2-pyridinyl]ethanone 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

2-[6-(2-phenylethyl)-2-pyridinyl]ethanol
CID 117001687
1-[6-acetyl-5-(2-phenylethyl)-2-pyridinyl]ethanone
CID 138967153
3-[[6-(2-phenylethyl)-2-pyridinyl]amino]butan-2-one
CID 13070823
1-[6-[2-(4-butylanilino)ethyl]-2-pyridinyl]ethanone
CID 174893005
1-[6-[(2-fluorophenyl)sulfanylmethyl]-2-pyridinyl]ethanone
CID 143311342
1-(6-ethyl-2-pyridinyl)ethanone;3-fluoro-3-methylpentane;propane
CID 167486425
2-[[6-(2-phenylethyl)pyridine-2-carbonyl]amino]-1H-benzimidazole-4-carboxylic acid
CID 68971249
1-[6-[6-[6-[6-(6-acetyl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]-2-pyridinyl]-2-pyridinyl]ethanone
CID 86093047
CID 88957229
CID 88957229
6-(benzylsulfonylmethyl)pyridine-2-carboxylic acid
CID 106903821
6-(fluoromethyl)pyridine-2-carboxylic acid;iridium
CID 58621414
methyl 6-(2-hydroxyethyl)pyridine-2-carboxylate
CID 55267203

Frequently Asked Questions

What is the IUPAC name of 1-[6-(2-phenylethyl)-2-pyridinyl]ethanone?
The IUPAC name of 1-[6-(2-phenylethyl)-2-pyridinyl]ethanone (CID 102432683) is 1-[6-(2-phenylethyl)-2-pyridinyl]ethanone.
What is the SMILES notation for 1-[6-(2-phenylethyl)-2-pyridinyl]ethanone?
The canonical SMILES for 1-[6-(2-phenylethyl)-2-pyridinyl]ethanone is CC(=O)c1cccc(CCc2ccccc2)n1.
What is the InChIKey of 1-[6-(2-phenylethyl)-2-pyridinyl]ethanone?
The InChIKey is UKGOJGZEGSBGQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO/c1-12(17)15-9-5-8-14(16-15)11-10-13-6-3-2-4-7-13/h2-9H,10-11H2,1H3.
What are the key properties of 1-[6-(2-phenylethyl)-2-pyridinyl]ethanone?
1-[6-(2-phenylethyl)-2-pyridinyl]ethanone has a molecular weight of 225.29 g/mol, XLogP of 3.07, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(2-phenylethyl)-2-pyridinyl]ethanone is sourced from PubChem (CID 102432683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).