1-cyclopentyl-2-methylpent-4-en-2-ol

C11H20O — CID 141162827

IUPAC1-cyclopentyl-2-methylpent-4-en-2-ol
SMILESC=CCC(C)(O)CC1CCCC1
InChIInChI=1S/C11H20O/c1-3-8-11(2,12)9-10-6-4-5-7-10/h3,10,12H,1,4-9H2,2H3
InChIKeyNKQVUMHYVMYSHT-UHFFFAOYSA-N
MW168.28 g/mol
LogP2.89
Rot. Bonds4

About 1-cyclopentyl-2-methylpent-4-en-2-ol

1-cyclopentyl-2-methylpent-4-en-2-ol (PubChem CID 141162827) has the molecular formula C11H20O and a molecular weight of 168.28 g/mol. Its IUPAC name is 1-cyclopentyl-2-methylpent-4-en-2-ol.

Molecular Properties

Compound Name1-cyclopentyl-2-methylpent-4-en-2-ol
PubChem CID141162827
Molecular FormulaC11H20O
Molecular Weight168.28 g/mol
Exact Mass168.15
IUPAC Name1-cyclopentyl-2-methylpent-4-en-2-ol
SMILESC=CCC(C)(O)CC1CCCC1
InChIInChI=1S/C11H20O/c1-3-8-11(2,12)9-10-6-4-5-7-10/h3,10,12H,1,4-9H2,2H3
InChIKeyNKQVUMHYVMYSHT-UHFFFAOYSA-N
XLogP2.89
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-2-methylpent-4-en-2-ol?
The IUPAC name of 1-cyclopentyl-2-methylpent-4-en-2-ol (CID 141162827) is 1-cyclopentyl-2-methylpent-4-en-2-ol.
What is the SMILES notation for 1-cyclopentyl-2-methylpent-4-en-2-ol?
The canonical SMILES for 1-cyclopentyl-2-methylpent-4-en-2-ol is C=CCC(C)(O)CC1CCCC1.
What is the InChIKey of 1-cyclopentyl-2-methylpent-4-en-2-ol?
The InChIKey is NKQVUMHYVMYSHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O/c1-3-8-11(2,12)9-10-6-4-5-7-10/h3,10,12H,1,4-9H2,2H3.
What are the key properties of 1-cyclopentyl-2-methylpent-4-en-2-ol?
1-cyclopentyl-2-methylpent-4-en-2-ol has a molecular weight of 168.28 g/mol, XLogP of 2.89, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-2-methylpent-4-en-2-ol is sourced from PubChem (CID 141162827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).