4-[2-[3-(4-cyclopentyl-2,3-dimethylbutyl)cyclopentyl]propyl]-2-propan-2-yloxolane

C26H48O — CID 129074779

IUPAC4-[2-[3-(4-cyclopentyl-2,3-dimethylbutyl)cyclopentyl]propyl]-2-propan-2-yloxolane
SMILESCC(C)C1CC(CC(C)C2CCC(CC(C)C(C)CC3CCCC3)C2)CO1
InChIInChI=1S/C26H48O/c1-18(2)26-16-24(17-27-26)14-21(5)25-11-10-23(15-25)13-20(4)19(3)12-22-8-6-7-9-22/h18-26H,6-17H2,1-5H3
InChIKeyOCZORTARHLQZRK-UHFFFAOYSA-N
MW376.67 g/mol
LogP7.73
Rot. Bonds9

About 4-[2-[3-(4-cyclopentyl-2,3-dimethylbutyl)cyclopentyl]propyl]-2-propan-2-yloxolane

4-[2-[3-(4-cyclopentyl-2,3-dimethylbutyl)cyclopentyl]propyl]-2-propan-2-yloxolane (PubChem CID 129074779) has the molecular formula C26H48O and a molecular weight of 376.67 g/mol. Its IUPAC name is 4-[2-[3-(4-cyclopentyl-2,3-dimethylbutyl)cyclopentyl]propyl]-2-propan-2-yloxolane.

Molecular Properties

Compound Name4-[2-[3-(4-cyclopentyl-2,3-dimethylbutyl)cyclopentyl]propyl]-2-propan-2-yloxolane
PubChem CID129074779
Molecular FormulaC26H48O
Molecular Weight376.67 g/mol
Exact Mass376.37
IUPAC Name4-[2-[3-(4-cyclopentyl-2,3-dimethylbutyl)cyclopentyl]propyl]-2-propan-2-yloxolane
SMILESCC(C)C1CC(CC(C)C2CCC(CC(C)C(C)CC3CCCC3)C2)CO1
InChIInChI=1S/C26H48O/c1-18(2)26-16-24(17-27-26)14-21(5)25-11-10-23(15-25)13-20(4)19(3)12-22-8-6-7-9-22/h18-26H,6-17H2,1-5H3
InChIKeyOCZORTARHLQZRK-UHFFFAOYSA-N
XLogP7.73
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.67
LogP ≤ 57.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 4-[2-[3-(4-cyclopentyl-2,3-dimethylbutyl)cyclopentyl]propyl]-2-propan-2-yloxolane with MolForge

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Related Compounds

2-cyclopropylpropylcyclobutane
CID 54087952
1-cyclopentylpropan-2-ylcyclopentane
CID 57131610
1-[3-[2-[3-[1-[3-(1-hydroxyethyl)cyclohexyl]propan-2-yl]cyclohexyl]propyl]cyclohexyl]ethanol
CID 70901269
(3-chloro-2-methylbutyl)cyclopentane
CID 63459666
5-ethyl-2-propan-2-yloxane
CID 129254270
2,3-dimethylbutylcyclodecane
CID 123220792
4-[1-[4-(1-cyclooctylpropan-2-yl)cyclononyl]propan-2-yl]-2,2,6,6-tetramethyloxane
CID 123307233
2-methylpropylcyclopentane;2-methylpropylcyclopropane
CID 159402972
(1S)-2-cyclohexyl-1-[(2S)-oxiran-2-yl]ethanamine
CID 141086747
4-(1-cyclopentylpropan-2-yl)piperidine
CID 131198877
2-methylpropylcyclohexane;2-methylpropylcyclopentane;2-methylpropylcyclopropane
CID 159692112
3-cyclohexyl-2-methylpropane-1,1-diol
CID 20647941

Frequently Asked Questions

What is the IUPAC name of 4-[2-[3-(4-cyclopentyl-2,3-dimethylbutyl)cyclopentyl]propyl]-2-propan-2-yloxolane?
The IUPAC name of 4-[2-[3-(4-cyclopentyl-2,3-dimethylbutyl)cyclopentyl]propyl]-2-propan-2-yloxolane (CID 129074779) is 4-[2-[3-(4-cyclopentyl-2,3-dimethylbutyl)cyclopentyl]propyl]-2-propan-2-yloxolane.
What is the SMILES notation for 4-[2-[3-(4-cyclopentyl-2,3-dimethylbutyl)cyclopentyl]propyl]-2-propan-2-yloxolane?
The canonical SMILES for 4-[2-[3-(4-cyclopentyl-2,3-dimethylbutyl)cyclopentyl]propyl]-2-propan-2-yloxolane is CC(C)C1CC(CC(C)C2CCC(CC(C)C(C)CC3CCCC3)C2)CO1.
What is the InChIKey of 4-[2-[3-(4-cyclopentyl-2,3-dimethylbutyl)cyclopentyl]propyl]-2-propan-2-yloxolane?
The InChIKey is OCZORTARHLQZRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H48O/c1-18(2)26-16-24(17-27-26)14-21(5)25-11-10-23(15-25)13-20(4)19(3)12-22-8-6-7-9-22/h18-26H,6-17H2,1-5H3.
What are the key properties of 4-[2-[3-(4-cyclopentyl-2,3-dimethylbutyl)cyclopentyl]propyl]-2-propan-2-yloxolane?
4-[2-[3-(4-cyclopentyl-2,3-dimethylbutyl)cyclopentyl]propyl]-2-propan-2-yloxolane has a molecular weight of 376.67 g/mol, XLogP of 7.73, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[3-(4-cyclopentyl-2,3-dimethylbutyl)cyclopentyl]propyl]-2-propan-2-yloxolane is sourced from PubChem (CID 129074779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).