1-cyclobutyl-2-cyclopropyl-2-ethoxyethanol

C11H20O2 — CID 116712819

IUPAC1-cyclobutyl-2-cyclopropyl-2-ethoxyethanol
SMILESCCOC(C1CC1)C(O)C1CCC1
InChIInChI=1S/C11H20O2/c1-2-13-11(9-6-7-9)10(12)8-4-3-5-8/h8-12H,2-7H2,1H3
InChIKeyHEQAINKSDUMRHM-UHFFFAOYSA-N
MW184.28 g/mol
LogP1.96
Rot. Bonds5

About 1-cyclobutyl-2-cyclopropyl-2-ethoxyethanol

1-cyclobutyl-2-cyclopropyl-2-ethoxyethanol (PubChem CID 116712819) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is 1-cyclobutyl-2-cyclopropyl-2-ethoxyethanol.

Molecular Properties

Compound Name1-cyclobutyl-2-cyclopropyl-2-ethoxyethanol
PubChem CID116712819
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name1-cyclobutyl-2-cyclopropyl-2-ethoxyethanol
SMILESCCOC(C1CC1)C(O)C1CCC1
InChIInChI=1S/C11H20O2/c1-2-13-11(9-6-7-9)10(12)8-4-3-5-8/h8-12H,2-7H2,1H3
InChIKeyHEQAINKSDUMRHM-UHFFFAOYSA-N
XLogP1.96
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclohexyl-1-cyclopentyl-2-ethoxyethanol
CID 116756693
2-cyclopropyl-2-ethoxy-1-(4-ethylcyclohexyl)ethanol
CID 116712860
2-cyclopropyl-2-ethoxy-1-(3-methylsulfonylcyclohexyl)ethanol
CID 116712704
1-cyclopropyl-1-ethoxy-3-methoxypropan-2-ol
CID 116712870
1-cycloheptyl-2-ethoxypropan-1-ol
CID 82931092
1-cyclopropyl-1-ethoxytetradecan-2-ol
CID 116712966
(1-cyclohexyl-2-cyclopropyl-2-ethoxyethyl)hydrazine
CID 105273087
2-cyclopropyl-2-ethoxy-N-ethyl-1-(3-methylcyclohexyl)ethanamine
CID 116723611
1-(2-cyclobutylphenyl)-2-cyclopropyl-2-ethoxyethanol
CID 114602475
1-cyclopropyl-1-ethoxy-3,3-dimethylbutan-2-amine
CID 116723219
1-cyclopropyl-1-ethoxyhept-6-yn-2-ol
CID 116712756
2-cyclohexyl-1-(3,5-difluorophenyl)-2-ethoxyethanol
CID 116756591

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-2-cyclopropyl-2-ethoxyethanol?
The IUPAC name of 1-cyclobutyl-2-cyclopropyl-2-ethoxyethanol (CID 116712819) is 1-cyclobutyl-2-cyclopropyl-2-ethoxyethanol.
What is the SMILES notation for 1-cyclobutyl-2-cyclopropyl-2-ethoxyethanol?
The canonical SMILES for 1-cyclobutyl-2-cyclopropyl-2-ethoxyethanol is CCOC(C1CC1)C(O)C1CCC1.
What is the InChIKey of 1-cyclobutyl-2-cyclopropyl-2-ethoxyethanol?
The InChIKey is HEQAINKSDUMRHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1-2-13-11(9-6-7-9)10(12)8-4-3-5-8/h8-12H,2-7H2,1H3.
What are the key properties of 1-cyclobutyl-2-cyclopropyl-2-ethoxyethanol?
1-cyclobutyl-2-cyclopropyl-2-ethoxyethanol has a molecular weight of 184.28 g/mol, XLogP of 1.96, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-2-cyclopropyl-2-ethoxyethanol is sourced from PubChem (CID 116712819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).