2-cyclopentyl-1-(2-ethoxyphenyl)ethanone

C15H20O2 — CID 115533350

IUPAC2-cyclopentyl-1-(2-ethoxyphenyl)ethanone
SMILESCCOc1ccccc1C(=O)CC1CCCC1
InChIInChI=1S/C15H20O2/c1-2-17-15-10-6-5-9-13(15)14(16)11-12-7-3-4-8-12/h5-6,9-10,12H,2-4,7-8,11H2,1H3
InChIKeyRHZVVTNZUBKDQK-UHFFFAOYSA-N
MW232.32 g/mol
LogP3.85
Rot. Bonds5

About 2-cyclopentyl-1-(2-ethoxyphenyl)ethanone

2-cyclopentyl-1-(2-ethoxyphenyl)ethanone (PubChem CID 115533350) has the molecular formula C15H20O2 and a molecular weight of 232.32 g/mol. Its IUPAC name is 2-cyclopentyl-1-(2-ethoxyphenyl)ethanone.

Molecular Properties

Compound Name2-cyclopentyl-1-(2-ethoxyphenyl)ethanone
PubChem CID115533350
Molecular FormulaC15H20O2
Molecular Weight232.32 g/mol
Exact Mass232.15
IUPAC Name2-cyclopentyl-1-(2-ethoxyphenyl)ethanone
SMILESCCOc1ccccc1C(=O)CC1CCCC1
InChIInChI=1S/C15H20O2/c1-2-17-15-10-6-5-9-13(15)14(16)11-12-7-3-4-8-12/h5-6,9-10,12H,2-4,7-8,11H2,1H3
InChIKeyRHZVVTNZUBKDQK-UHFFFAOYSA-N
XLogP3.85
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-1-(2-ethoxyphenyl)ethanone?
The IUPAC name of 2-cyclopentyl-1-(2-ethoxyphenyl)ethanone (CID 115533350) is 2-cyclopentyl-1-(2-ethoxyphenyl)ethanone.
What is the SMILES notation for 2-cyclopentyl-1-(2-ethoxyphenyl)ethanone?
The canonical SMILES for 2-cyclopentyl-1-(2-ethoxyphenyl)ethanone is CCOc1ccccc1C(=O)CC1CCCC1.
What is the InChIKey of 2-cyclopentyl-1-(2-ethoxyphenyl)ethanone?
The InChIKey is RHZVVTNZUBKDQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20O2/c1-2-17-15-10-6-5-9-13(15)14(16)11-12-7-3-4-8-12/h5-6,9-10,12H,2-4,7-8,11H2,1H3.
What are the key properties of 2-cyclopentyl-1-(2-ethoxyphenyl)ethanone?
2-cyclopentyl-1-(2-ethoxyphenyl)ethanone has a molecular weight of 232.32 g/mol, XLogP of 3.85, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-1-(2-ethoxyphenyl)ethanone is sourced from PubChem (CID 115533350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).