(3-ethylphenyl)-(5-methyl-3-pyridinyl)methanone

C15H15NO — CID 105120270

IUPAC(3-ethylphenyl)-(5-methyl-3-pyridinyl)methanone
SMILESCCc1cccc(C(=O)c2cncc(C)c2)c1
InChIInChI=1S/C15H15NO/c1-3-12-5-4-6-13(8-12)15(17)14-7-11(2)9-16-10-14/h4-10H,3H2,1-2H3
InChIKeyLKLULSJYKMYFLN-UHFFFAOYSA-N
MW225.29 g/mol
LogP3.18
Rot. Bonds3

About (3-ethylphenyl)-(5-methyl-3-pyridinyl)methanone

(3-ethylphenyl)-(5-methyl-3-pyridinyl)methanone (PubChem CID 105120270) has the molecular formula C15H15NO and a molecular weight of 225.29 g/mol. Its IUPAC name is (3-ethylphenyl)-(5-methyl-3-pyridinyl)methanone.

Molecular Properties

Compound Name(3-ethylphenyl)-(5-methyl-3-pyridinyl)methanone
PubChem CID105120270
Molecular FormulaC15H15NO
Molecular Weight225.29 g/mol
Exact Mass225.12
IUPAC Name(3-ethylphenyl)-(5-methyl-3-pyridinyl)methanone
SMILESCCc1cccc(C(=O)c2cncc(C)c2)c1
InChIInChI=1S/C15H15NO/c1-3-12-5-4-6-13(8-12)15(17)14-7-11(2)9-16-10-14/h4-10H,3H2,1-2H3
InChIKeyLKLULSJYKMYFLN-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

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Related Compounds

(3-ethylphenyl)-(4-methyl-3-pyridinyl)methanone
CID 114877566
(4-aminophenyl)-(3-ethylphenyl)methanone
CID 116548793
(3,5-dichlorophenyl)-(3-ethylphenyl)methanone
CID 115788788
(5-methyl-3-pyridinyl)-(4-phenylphenyl)methanone
CID 105103449
(3,5-dimethylphenyl)-(3-propylphenyl)methanone
CID 115811990
(3-fluoro-4-methylphenyl)-(5-methyl-3-pyridinyl)methanone
CID 115373910
(3-ethylthiophen-2-yl)-(5-methyl-3-pyridinyl)methanone
CID 115791581
bis(3-methylphenyl)methanone
CID 17848
(3-ethylphenyl)-(1-phenylpyrazol-4-yl)methanone
CID 105120280
3-ethylbenzoic acid;propane
CID 177324794
(5-methyl-3-pyridinyl)-pyrimidin-2-ylmethanone
CID 115373915
(3-fluoro-5-methylphenyl)-(5-methyl-3-pyridinyl)methanone
CID 115374080

Frequently Asked Questions

What is the IUPAC name of (3-ethylphenyl)-(5-methyl-3-pyridinyl)methanone?
The IUPAC name of (3-ethylphenyl)-(5-methyl-3-pyridinyl)methanone (CID 105120270) is (3-ethylphenyl)-(5-methyl-3-pyridinyl)methanone.
What is the SMILES notation for (3-ethylphenyl)-(5-methyl-3-pyridinyl)methanone?
The canonical SMILES for (3-ethylphenyl)-(5-methyl-3-pyridinyl)methanone is CCc1cccc(C(=O)c2cncc(C)c2)c1.
What is the InChIKey of (3-ethylphenyl)-(5-methyl-3-pyridinyl)methanone?
The InChIKey is LKLULSJYKMYFLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO/c1-3-12-5-4-6-13(8-12)15(17)14-7-11(2)9-16-10-14/h4-10H,3H2,1-2H3.
What are the key properties of (3-ethylphenyl)-(5-methyl-3-pyridinyl)methanone?
(3-ethylphenyl)-(5-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)-(5-methyl-3-pyridinyl)methanone is sourced from PubChem (CID 105120270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).