2-cyclopentyl-1-(3-methoxy-4-methylphenyl)ethanone

C15H20O2 — CID 114969347

IUPAC2-cyclopentyl-1-(3-methoxy-4-methylphenyl)ethanone
SMILESCOc1cc(C(=O)CC2CCCC2)ccc1C
InChIInChI=1S/C15H20O2/c1-11-7-8-13(10-15(11)17-2)14(16)9-12-5-3-4-6-12/h7-8,10,12H,3-6,9H2,1-2H3
InChIKeyWSBRXLHUWUNGRS-UHFFFAOYSA-N
MW232.32 g/mol
LogP3.77
Rot. Bonds4

About 2-cyclopentyl-1-(3-methoxy-4-methylphenyl)ethanone

2-cyclopentyl-1-(3-methoxy-4-methylphenyl)ethanone (PubChem CID 114969347) has the molecular formula C15H20O2 and a molecular weight of 232.32 g/mol. Its IUPAC name is 2-cyclopentyl-1-(3-methoxy-4-methylphenyl)ethanone.

Molecular Properties

Compound Name2-cyclopentyl-1-(3-methoxy-4-methylphenyl)ethanone
PubChem CID114969347
Molecular FormulaC15H20O2
Molecular Weight232.32 g/mol
Exact Mass232.15
IUPAC Name2-cyclopentyl-1-(3-methoxy-4-methylphenyl)ethanone
SMILESCOc1cc(C(=O)CC2CCCC2)ccc1C
InChIInChI=1S/C15H20O2/c1-11-7-8-13(10-15(11)17-2)14(16)9-12-5-3-4-6-12/h7-8,10,12H,3-6,9H2,1-2H3
InChIKeyWSBRXLHUWUNGRS-UHFFFAOYSA-N
XLogP3.77
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-cyclopentyl-1-(3-methoxy-4-methylphenyl)propan-1-one
CID 114192912
2-cyclohexyl-1-(6-methoxynaphthalen-2-yl)ethanone
CID 63491322
2-[4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexyl]-1-(3-methoxy-4-methylphenyl)ethanone
CID 161431554
1-(3-methoxy-4-methylphenyl)propan-1-one
CID 71349712
2-cyclohexyl-1-(4-fluoro-3-methylphenyl)ethanone
CID 55096170
N-cyclopentyl-N-ethyl-3-methoxy-4-methylbenzamide
CID 134060958
2-cycloheptyl-1-(2-methoxy-4,6-dimethylphenyl)ethanone
CID 106682017
(2-ethylcyclohexyl)-(3-methoxy-4-methylphenyl)methanone
CID 114973789
2-cycloheptyl-1-(3,5-dimethoxyphenyl)ethanone
CID 115785355
2-cyclohexyl-1-(2-methyl-4-pyridinyl)ethanone
CID 106754594
(4-ethylcyclohexyl)-(3-methoxy-4-methylphenyl)methanone
CID 114975950
2-(8-azabicyclo[3.2.1]octan-3-yl)-1-(3,4-dimethoxyphenyl)ethanone
CID 116588327

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-1-(3-methoxy-4-methylphenyl)ethanone?
The IUPAC name of 2-cyclopentyl-1-(3-methoxy-4-methylphenyl)ethanone (CID 114969347) is 2-cyclopentyl-1-(3-methoxy-4-methylphenyl)ethanone.
What is the SMILES notation for 2-cyclopentyl-1-(3-methoxy-4-methylphenyl)ethanone?
The canonical SMILES for 2-cyclopentyl-1-(3-methoxy-4-methylphenyl)ethanone is COc1cc(C(=O)CC2CCCC2)ccc1C.
What is the InChIKey of 2-cyclopentyl-1-(3-methoxy-4-methylphenyl)ethanone?
The InChIKey is WSBRXLHUWUNGRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20O2/c1-11-7-8-13(10-15(11)17-2)14(16)9-12-5-3-4-6-12/h7-8,10,12H,3-6,9H2,1-2H3.
What are the key properties of 2-cyclopentyl-1-(3-methoxy-4-methylphenyl)ethanone?
2-cyclopentyl-1-(3-methoxy-4-methylphenyl)ethanone has a molecular weight of 232.32 g/mol, XLogP of 3.77, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-1-(3-methoxy-4-methylphenyl)ethanone is sourced from PubChem (CID 114969347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).