(3-ethylphenyl)-(4-methyl-3-pyridinyl)methanone

C15H15NO — CID 114877566

IUPAC(3-ethylphenyl)-(4-methyl-3-pyridinyl)methanone
SMILESCCc1cccc(C(=O)c2cnccc2C)c1
InChIInChI=1S/C15H15NO/c1-3-12-5-4-6-13(9-12)15(17)14-10-16-8-7-11(14)2/h4-10H,3H2,1-2H3
InChIKeyLZSODHSXVMLRPW-UHFFFAOYSA-N
MW225.29 g/mol
LogP3.18
Rot. Bonds3

About (3-ethylphenyl)-(4-methyl-3-pyridinyl)methanone

(3-ethylphenyl)-(4-methyl-3-pyridinyl)methanone (PubChem CID 114877566) has the molecular formula C15H15NO and a molecular weight of 225.29 g/mol. Its IUPAC name is (3-ethylphenyl)-(4-methyl-3-pyridinyl)methanone.

Molecular Properties

Compound Name(3-ethylphenyl)-(4-methyl-3-pyridinyl)methanone
PubChem CID114877566
Molecular FormulaC15H15NO
Molecular Weight225.29 g/mol
Exact Mass225.12
IUPAC Name(3-ethylphenyl)-(4-methyl-3-pyridinyl)methanone
SMILESCCc1cccc(C(=O)c2cnccc2C)c1
InChIInChI=1S/C15H15NO/c1-3-12-5-4-6-13(9-12)15(17)14-10-16-8-7-11(14)2/h4-10H,3H2,1-2H3
InChIKeyLZSODHSXVMLRPW-UHFFFAOYSA-N
XLogP3.18
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (3-ethylphenyl)-(4-methyl-3-pyridinyl)methanone 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 (3-ethylphenyl)-(4-methyl-3-pyridinyl)methanone?
The IUPAC name of (3-ethylphenyl)-(4-methyl-3-pyridinyl)methanone (CID 114877566) is (3-ethylphenyl)-(4-methyl-3-pyridinyl)methanone.
What is the SMILES notation for (3-ethylphenyl)-(4-methyl-3-pyridinyl)methanone?
The canonical SMILES for (3-ethylphenyl)-(4-methyl-3-pyridinyl)methanone is CCc1cccc(C(=O)c2cnccc2C)c1.
What is the InChIKey of (3-ethylphenyl)-(4-methyl-3-pyridinyl)methanone?
The InChIKey is LZSODHSXVMLRPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO/c1-3-12-5-4-6-13(9-12)15(17)14-10-16-8-7-11(14)2/h4-10H,3H2,1-2H3.
What are the key properties of (3-ethylphenyl)-(4-methyl-3-pyridinyl)methanone?
(3-ethylphenyl)-(4-methyl-3-pyridinyl)methanone has a molecular weight of 225.29 g/mol, XLogP of 3.18, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethylphenyl)-(4-methyl-3-pyridinyl)methanone is sourced from PubChem (CID 114877566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).