1-(6-hydroxyhexyl)cyclopentan-1-ol

C11H22O2 — CID 70524095

IUPAC1-(6-hydroxyhexyl)cyclopentan-1-ol
SMILESOCCCCCCC1(O)CCCC1
InChIInChI=1S/C11H22O2/c12-10-6-2-1-3-7-11(13)8-4-5-9-11/h12-13H,1-10H2
InChIKeyDKQCRQRQRJXAQO-UHFFFAOYSA-N
MW186.29 g/mol
LogP2.23
Rot. Bonds6

About 1-(6-hydroxyhexyl)cyclopentan-1-ol

1-(6-hydroxyhexyl)cyclopentan-1-ol (PubChem CID 70524095) has the molecular formula C11H22O2 and a molecular weight of 186.29 g/mol. Its IUPAC name is 1-(6-hydroxyhexyl)cyclopentan-1-ol.

Molecular Properties

Compound Name1-(6-hydroxyhexyl)cyclopentan-1-ol
PubChem CID70524095
Molecular FormulaC11H22O2
Molecular Weight186.29 g/mol
Exact Mass186.16
IUPAC Name1-(6-hydroxyhexyl)cyclopentan-1-ol
SMILESOCCCCCCC1(O)CCCC1
InChIInChI=1S/C11H22O2/c12-10-6-2-1-3-7-11(13)8-4-5-9-11/h12-13H,1-10H2
InChIKeyDKQCRQRQRJXAQO-UHFFFAOYSA-N
XLogP2.23
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.29
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-(6-hydroxyhexyl)cyclopentan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(6-hydroxyhexyl)cyclopentan-1-ol?
The IUPAC name of 1-(6-hydroxyhexyl)cyclopentan-1-ol (CID 70524095) is 1-(6-hydroxyhexyl)cyclopentan-1-ol.
What is the SMILES notation for 1-(6-hydroxyhexyl)cyclopentan-1-ol?
The canonical SMILES for 1-(6-hydroxyhexyl)cyclopentan-1-ol is OCCCCCCC1(O)CCCC1.
What is the InChIKey of 1-(6-hydroxyhexyl)cyclopentan-1-ol?
The InChIKey is DKQCRQRQRJXAQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O2/c12-10-6-2-1-3-7-11(13)8-4-5-9-11/h12-13H,1-10H2.
What are the key properties of 1-(6-hydroxyhexyl)cyclopentan-1-ol?
1-(6-hydroxyhexyl)cyclopentan-1-ol has a molecular weight of 186.29 g/mol, XLogP of 2.23, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-hydroxyhexyl)cyclopentan-1-ol is sourced from PubChem (CID 70524095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).