4-cyclopentyl-2-methylbutan-2-ol

C10H20O — CID 22728826

IUPAC4-cyclopentyl-2-methylbutan-2-ol
SMILESCC(C)(O)CCC1CCCC1
InChIInChI=1S/C10H20O/c1-10(2,11)8-7-9-5-3-4-6-9/h9,11H,3-8H2,1-2H3
InChIKeyFSZWOPFFVMYSPF-UHFFFAOYSA-N
MW156.27 g/mol
LogP2.73
Rot. Bonds3

About 4-cyclopentyl-2-methylbutan-2-ol

4-cyclopentyl-2-methylbutan-2-ol (PubChem CID 22728826) has the molecular formula C10H20O and a molecular weight of 156.27 g/mol. Its IUPAC name is 4-cyclopentyl-2-methylbutan-2-ol.

Molecular Properties

Compound Name4-cyclopentyl-2-methylbutan-2-ol
PubChem CID22728826
Molecular FormulaC10H20O
Molecular Weight156.27 g/mol
Exact Mass156.15
IUPAC Name4-cyclopentyl-2-methylbutan-2-ol
SMILESCC(C)(O)CCC1CCCC1
InChIInChI=1S/C10H20O/c1-10(2,11)8-7-9-5-3-4-6-9/h9,11H,3-8H2,1-2H3
InChIKeyFSZWOPFFVMYSPF-UHFFFAOYSA-N
XLogP2.73
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-2-methylbutan-2-ol?
The IUPAC name of 4-cyclopentyl-2-methylbutan-2-ol (CID 22728826) is 4-cyclopentyl-2-methylbutan-2-ol.
What is the SMILES notation for 4-cyclopentyl-2-methylbutan-2-ol?
The canonical SMILES for 4-cyclopentyl-2-methylbutan-2-ol is CC(C)(O)CCC1CCCC1.
What is the InChIKey of 4-cyclopentyl-2-methylbutan-2-ol?
The InChIKey is FSZWOPFFVMYSPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O/c1-10(2,11)8-7-9-5-3-4-6-9/h9,11H,3-8H2,1-2H3.
What are the key properties of 4-cyclopentyl-2-methylbutan-2-ol?
4-cyclopentyl-2-methylbutan-2-ol has a molecular weight of 156.27 g/mol, XLogP of 2.73, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-2-methylbutan-2-ol is sourced from PubChem (CID 22728826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).