[1-(2-methylpropyl)cyclopentyl]-(2,2,5,5-tetramethyloxolan-3-yl)methanol

C18H34O2 — CID 115838851

IUPAC[1-(2-methylpropyl)cyclopentyl]-(2,2,5,5-tetramethyloxolan-3-yl)methanol
SMILESCC(C)CC1(C(O)C2CC(C)(C)OC2(C)C)CCCC1
InChIInChI=1S/C18H34O2/c1-13(2)11-18(9-7-8-10-18)15(19)14-12-16(3,4)20-17(14,5)6/h13-15,19H,7-12H2,1-6H3
InChIKeyZRRFEUBLRPSALM-UHFFFAOYSA-N
MW282.47 g/mol
LogP4.55
Rot. Bonds4

About [1-(2-methylpropyl)cyclopentyl]-(2,2,5,5-tetramethyloxolan-3-yl)methanol

[1-(2-methylpropyl)cyclopentyl]-(2,2,5,5-tetramethyloxolan-3-yl)methanol (PubChem CID 115838851) has the molecular formula C18H34O2 and a molecular weight of 282.47 g/mol. Its IUPAC name is [1-(2-methylpropyl)cyclopentyl]-(2,2,5,5-tetramethyloxolan-3-yl)methanol.

Molecular Properties

Compound Name[1-(2-methylpropyl)cyclopentyl]-(2,2,5,5-tetramethyloxolan-3-yl)methanol
PubChem CID115838851
Molecular FormulaC18H34O2
Molecular Weight282.47 g/mol
Exact Mass282.26
IUPAC Name[1-(2-methylpropyl)cyclopentyl]-(2,2,5,5-tetramethyloxolan-3-yl)methanol
SMILESCC(C)CC1(C(O)C2CC(C)(C)OC2(C)C)CCCC1
InChIInChI=1S/C18H34O2/c1-13(2)11-18(9-7-8-10-18)15(19)14-12-16(3,4)20-17(14,5)6/h13-15,19H,7-12H2,1-6H3
InChIKeyZRRFEUBLRPSALM-UHFFFAOYSA-N
XLogP4.55
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-(2-methylpropyl)cyclopentyl]-(2,2,5,5-tetramethyloxolan-3-yl)methanol?
The IUPAC name of [1-(2-methylpropyl)cyclopentyl]-(2,2,5,5-tetramethyloxolan-3-yl)methanol (CID 115838851) is [1-(2-methylpropyl)cyclopentyl]-(2,2,5,5-tetramethyloxolan-3-yl)methanol.
What is the SMILES notation for [1-(2-methylpropyl)cyclopentyl]-(2,2,5,5-tetramethyloxolan-3-yl)methanol?
The canonical SMILES for [1-(2-methylpropyl)cyclopentyl]-(2,2,5,5-tetramethyloxolan-3-yl)methanol is CC(C)CC1(C(O)C2CC(C)(C)OC2(C)C)CCCC1.
What is the InChIKey of [1-(2-methylpropyl)cyclopentyl]-(2,2,5,5-tetramethyloxolan-3-yl)methanol?
The InChIKey is ZRRFEUBLRPSALM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34O2/c1-13(2)11-18(9-7-8-10-18)15(19)14-12-16(3,4)20-17(14,5)6/h13-15,19H,7-12H2,1-6H3.
What are the key properties of [1-(2-methylpropyl)cyclopentyl]-(2,2,5,5-tetramethyloxolan-3-yl)methanol?
[1-(2-methylpropyl)cyclopentyl]-(2,2,5,5-tetramethyloxolan-3-yl)methanol has a molecular weight of 282.47 g/mol, XLogP of 4.55, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-methylpropyl)cyclopentyl]-(2,2,5,5-tetramethyloxolan-3-yl)methanol is sourced from PubChem (CID 115838851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).