1-(2-cyclopentyl-4-phenylphenyl)ethanone

C19H20O — CID 134842938

IUPAC1-(2-cyclopentyl-4-phenylphenyl)ethanone
SMILESCC(=O)c1ccc(-c2ccccc2)cc1C1CCCC1
InChIInChI=1S/C19H20O/c1-14(20)18-12-11-17(15-7-3-2-4-8-15)13-19(18)16-9-5-6-10-16/h2-4,7-8,11-13,16H,5-6,9-10H2,1H3
InChIKeyDFEFMXPNTCGCOO-UHFFFAOYSA-N
MW264.37 g/mol
LogP5.21
Rot. Bonds3

About 1-(2-cyclopentyl-4-phenylphenyl)ethanone

1-(2-cyclopentyl-4-phenylphenyl)ethanone (PubChem CID 134842938) has the molecular formula C19H20O and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-(2-cyclopentyl-4-phenylphenyl)ethanone.

Molecular Properties

Compound Name1-(2-cyclopentyl-4-phenylphenyl)ethanone
PubChem CID134842938
Molecular FormulaC19H20O
Molecular Weight264.37 g/mol
Exact Mass264.15
IUPAC Name1-(2-cyclopentyl-4-phenylphenyl)ethanone
SMILESCC(=O)c1ccc(-c2ccccc2)cc1C1CCCC1
InChIInChI=1S/C19H20O/c1-14(20)18-12-11-17(15-7-3-2-4-8-15)13-19(18)16-9-5-6-10-16/h2-4,7-8,11-13,16H,5-6,9-10H2,1H3
InChIKeyDFEFMXPNTCGCOO-UHFFFAOYSA-N
XLogP5.21
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500264.37
LogP ≤ 55.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-cyclopentyl-4-(5-phenyl-1H-indol-3-yl)benzoic acid
CID 53316137
1-[2-methyl-4-(4-phenylphenyl)phenyl]ethanone
CID 20716213
2-cyclopentyl-4-(5-phenylpyrazolo[1,5-a]pyridin-3-yl)benzoic acid
CID 164617874
2-cyclopentyl-4-[6-(3-methylphenyl)pyrrolo[1,2-b]pyridazin-4-yl]benzoic acid
CID 166128290
2-cyclopentylterephthalic acid
CID 174865784
1-[2-(4-cyclohexylphenyl)quinolin-4-yl]ethanone
CID 145465094
2-cyclopentyl-4-(1-methylpyrrolo[2,3-b]pyridin-3-yl)benzoic acid
CID 164614546
(2-cyclohexyl-4-nitrophenyl)-phenylmethanone
CID 151612232
(2-cyclohexylphenyl)-(2-methylphenyl)methanone
CID 86030332
2-(3-acetyl-4-cyclohexylphenyl)-2-chloroacetic acid
CID 21454147
4-cyclopentyl-7-phenylisoquinoline
CID 70704187
1-(2-bromo-4-methoxyphenyl)ethanone;1-(2-bromo-4-phenylphenyl)ethanone
CID 70275745

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclopentyl-4-phenylphenyl)ethanone?
The IUPAC name of 1-(2-cyclopentyl-4-phenylphenyl)ethanone (CID 134842938) is 1-(2-cyclopentyl-4-phenylphenyl)ethanone.
What is the SMILES notation for 1-(2-cyclopentyl-4-phenylphenyl)ethanone?
The canonical SMILES for 1-(2-cyclopentyl-4-phenylphenyl)ethanone is CC(=O)c1ccc(-c2ccccc2)cc1C1CCCC1.
What is the InChIKey of 1-(2-cyclopentyl-4-phenylphenyl)ethanone?
The InChIKey is DFEFMXPNTCGCOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20O/c1-14(20)18-12-11-17(15-7-3-2-4-8-15)13-19(18)16-9-5-6-10-16/h2-4,7-8,11-13,16H,5-6,9-10H2,1H3.
What are the key properties of 1-(2-cyclopentyl-4-phenylphenyl)ethanone?
1-(2-cyclopentyl-4-phenylphenyl)ethanone has a molecular weight of 264.37 g/mol, XLogP of 5.21, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclopentyl-4-phenylphenyl)ethanone is sourced from PubChem (CID 134842938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).