1-cyclopentyl-2-(2-ethylcyclohexyl)oxyethanone

C15H26O2 — CID 104751673

IUPAC1-cyclopentyl-2-(2-ethylcyclohexyl)oxyethanone
SMILESCCC1CCCCC1OCC(=O)C1CCCC1
InChIInChI=1S/C15H26O2/c1-2-12-7-5-6-10-15(12)17-11-14(16)13-8-3-4-9-13/h12-13,15H,2-11H2,1H3
InChIKeyLOOZSTLNGULVLL-UHFFFAOYSA-N
MW238.37 g/mol
LogP3.73
Rot. Bonds5

About 1-cyclopentyl-2-(2-ethylcyclohexyl)oxyethanone

1-cyclopentyl-2-(2-ethylcyclohexyl)oxyethanone (PubChem CID 104751673) has the molecular formula C15H26O2 and a molecular weight of 238.37 g/mol. Its IUPAC name is 1-cyclopentyl-2-(2-ethylcyclohexyl)oxyethanone.

Molecular Properties

Compound Name1-cyclopentyl-2-(2-ethylcyclohexyl)oxyethanone
PubChem CID104751673
Molecular FormulaC15H26O2
Molecular Weight238.37 g/mol
Exact Mass238.19
IUPAC Name1-cyclopentyl-2-(2-ethylcyclohexyl)oxyethanone
SMILESCCC1CCCCC1OCC(=O)C1CCCC1
InChIInChI=1S/C15H26O2/c1-2-12-7-5-6-10-15(12)17-11-14(16)13-8-3-4-9-13/h12-13,15H,2-11H2,1H3
InChIKeyLOOZSTLNGULVLL-UHFFFAOYSA-N
XLogP3.73
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-ethylcyclohexyl)oxy-1-(oxolan-3-yl)ethanone
CID 104751674
ethyl 2-(2-ethylcyclohexyl)oxyacetate
CID 43119660
2-[(2-ethylcyclohexyl)oxymethyl]prop-2-ene-1-thiol
CID 103073679
ethyl 3-(2-ethylcyclohexyl)oxypropanoate
CID 43365260
1-ethyl-2-hydroperoxycyclohexane
CID 175085860
(2-ethylcyclohexyl) 3-sulfanylpropanoate
CID 107018376
1-(3-bromothiophen-2-yl)-2-(2-ethylcyclohexyl)oxyethanone
CID 43798171
2-(ethylamino)-4-(2-ethylcyclohexyl)oxybutanamide
CID 63041537
2-ethyl-4-(2-ethylcyclohexyl)oxybut-2-enoic acid
CID 77100571
2-[1-[(2-ethylcyclohexyl)oxymethyl]cyclopropyl]acetic acid
CID 65498472
1-(2,4-difluorophenyl)-2-(2-ethylcyclohexyl)oxyethanone
CID 43798188
3-(2-ethylcyclohexyl)oxypropanal
CID 63041156

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-2-(2-ethylcyclohexyl)oxyethanone?
The IUPAC name of 1-cyclopentyl-2-(2-ethylcyclohexyl)oxyethanone (CID 104751673) is 1-cyclopentyl-2-(2-ethylcyclohexyl)oxyethanone.
What is the SMILES notation for 1-cyclopentyl-2-(2-ethylcyclohexyl)oxyethanone?
The canonical SMILES for 1-cyclopentyl-2-(2-ethylcyclohexyl)oxyethanone is CCC1CCCCC1OCC(=O)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-2-(2-ethylcyclohexyl)oxyethanone?
The InChIKey is LOOZSTLNGULVLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26O2/c1-2-12-7-5-6-10-15(12)17-11-14(16)13-8-3-4-9-13/h12-13,15H,2-11H2,1H3.
What are the key properties of 1-cyclopentyl-2-(2-ethylcyclohexyl)oxyethanone?
1-cyclopentyl-2-(2-ethylcyclohexyl)oxyethanone has a molecular weight of 238.37 g/mol, XLogP of 3.73, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-2-(2-ethylcyclohexyl)oxyethanone is sourced from PubChem (CID 104751673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).