(3-cyclobutyl-2-ethoxy-2-methylpropyl)cyclopentane

C15H28O — CID 57320080

IUPAC(3-cyclobutyl-2-ethoxy-2-methylpropyl)cyclopentane
SMILESCCOC(C)(CC1CCCC1)CC1CCC1
InChIInChI=1S/C15H28O/c1-3-16-15(2,12-14-9-6-10-14)11-13-7-4-5-8-13/h13-14H,3-12H2,1-2H3
InChIKeyAFQSFCLOKIBBOB-UHFFFAOYSA-N
MW224.39 g/mol
LogP4.55
Rot. Bonds6

About (3-cyclobutyl-2-ethoxy-2-methylpropyl)cyclopentane

(3-cyclobutyl-2-ethoxy-2-methylpropyl)cyclopentane (PubChem CID 57320080) has the molecular formula C15H28O and a molecular weight of 224.39 g/mol. Its IUPAC name is (3-cyclobutyl-2-ethoxy-2-methylpropyl)cyclopentane.

Molecular Properties

Compound Name(3-cyclobutyl-2-ethoxy-2-methylpropyl)cyclopentane
PubChem CID57320080
Molecular FormulaC15H28O
Molecular Weight224.39 g/mol
Exact Mass224.21
IUPAC Name(3-cyclobutyl-2-ethoxy-2-methylpropyl)cyclopentane
SMILESCCOC(C)(CC1CCCC1)CC1CCC1
InChIInChI=1S/C15H28O/c1-3-16-15(2,12-14-9-6-10-14)11-13-7-4-5-8-13/h13-14H,3-12H2,1-2H3
InChIKeyAFQSFCLOKIBBOB-UHFFFAOYSA-N
XLogP4.55
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (3-cyclobutyl-2-ethoxy-2-methylpropyl)cyclopentane?
The IUPAC name of (3-cyclobutyl-2-ethoxy-2-methylpropyl)cyclopentane (CID 57320080) is (3-cyclobutyl-2-ethoxy-2-methylpropyl)cyclopentane.
What is the SMILES notation for (3-cyclobutyl-2-ethoxy-2-methylpropyl)cyclopentane?
The canonical SMILES for (3-cyclobutyl-2-ethoxy-2-methylpropyl)cyclopentane is CCOC(C)(CC1CCCC1)CC1CCC1.
What is the InChIKey of (3-cyclobutyl-2-ethoxy-2-methylpropyl)cyclopentane?
The InChIKey is AFQSFCLOKIBBOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28O/c1-3-16-15(2,12-14-9-6-10-14)11-13-7-4-5-8-13/h13-14H,3-12H2,1-2H3.
What are the key properties of (3-cyclobutyl-2-ethoxy-2-methylpropyl)cyclopentane?
(3-cyclobutyl-2-ethoxy-2-methylpropyl)cyclopentane has a molecular weight of 224.39 g/mol, XLogP of 4.55, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-cyclobutyl-2-ethoxy-2-methylpropyl)cyclopentane is sourced from PubChem (CID 57320080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).