1-pentylcyclopentan-1-ol

C10H20O — CID 549095

IUPAC1-pentylcyclopentan-1-ol
SMILESCCCCCC1(O)CCCC1
InChIInChI=1S/C10H20O/c1-2-3-4-7-10(11)8-5-6-9-10/h11H,2-9H2,1H3
InChIKeyLPRXLSZAZXWDMY-UHFFFAOYSA-N
MW156.27 g/mol
LogP2.87
Rot. Bonds4

About 1-pentylcyclopentan-1-ol

1-pentylcyclopentan-1-ol (PubChem CID 549095) has the molecular formula C10H20O and a molecular weight of 156.27 g/mol. Its IUPAC name is 1-pentylcyclopentan-1-ol.

Molecular Properties

Compound Name1-pentylcyclopentan-1-ol
PubChem CID549095
Molecular FormulaC10H20O
Molecular Weight156.27 g/mol
Exact Mass156.15
IUPAC Name1-pentylcyclopentan-1-ol
SMILESCCCCCC1(O)CCCC1
InChIInChI=1S/C10H20O/c1-2-3-4-7-10(11)8-5-6-9-10/h11H,2-9H2,1H3
InChIKeyLPRXLSZAZXWDMY-UHFFFAOYSA-N
XLogP2.87
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-pentylcyclopentan-1-ol?
The IUPAC name of 1-pentylcyclopentan-1-ol (CID 549095) is 1-pentylcyclopentan-1-ol.
What is the SMILES notation for 1-pentylcyclopentan-1-ol?
The canonical SMILES for 1-pentylcyclopentan-1-ol is CCCCCC1(O)CCCC1.
What is the InChIKey of 1-pentylcyclopentan-1-ol?
The InChIKey is LPRXLSZAZXWDMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O/c1-2-3-4-7-10(11)8-5-6-9-10/h11H,2-9H2,1H3.
What are the key properties of 1-pentylcyclopentan-1-ol?
1-pentylcyclopentan-1-ol has a molecular weight of 156.27 g/mol, XLogP of 2.87, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pentylcyclopentan-1-ol is sourced from PubChem (CID 549095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).