1-(4-cyclopentylphenyl)hexan-1-ol

C17H26O — CID 91233072

IUPAC1-(4-cyclopentylphenyl)hexan-1-ol
SMILESCCCCCC(O)c1ccc(C2CCCC2)cc1
InChIInChI=1S/C17H26O/c1-2-3-4-9-17(18)16-12-10-15(11-13-16)14-7-5-6-8-14/h10-14,17-18H,2-9H2,1H3
InChIKeyUBGBVUJXJGITND-UHFFFAOYSA-N
MW246.39 g/mol
LogP4.96
Rot. Bonds6

About 1-(4-cyclopentylphenyl)hexan-1-ol

1-(4-cyclopentylphenyl)hexan-1-ol (PubChem CID 91233072) has the molecular formula C17H26O and a molecular weight of 246.39 g/mol. Its IUPAC name is 1-(4-cyclopentylphenyl)hexan-1-ol.

Molecular Properties

Compound Name1-(4-cyclopentylphenyl)hexan-1-ol
PubChem CID91233072
Molecular FormulaC17H26O
Molecular Weight246.39 g/mol
Exact Mass246.20
IUPAC Name1-(4-cyclopentylphenyl)hexan-1-ol
SMILESCCCCCC(O)c1ccc(C2CCCC2)cc1
InChIInChI=1S/C17H26O/c1-2-3-4-9-17(18)16-12-10-15(11-13-16)14-7-5-6-8-14/h10-14,17-18H,2-9H2,1H3
InChIKeyUBGBVUJXJGITND-UHFFFAOYSA-N
XLogP4.96
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.39
LogP ≤ 54.96
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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Related Compounds

1-(4-cyclohexylphenyl)octan-1-ol
CID 63426970
1-(4-cyclopropylphenyl)octan-1-ol
CID 79980004
1-[4-[(1S,2S)-2-chlorocyclopentyl]phenyl]hexan-1-ol
CID 143942234
1-(4-cyclohexylphenyl)hexan-1-amine
CID 43125388
1-[4-(3-fluorocyclopentyl)phenyl]hexan-1-ol
CID 70970008
1-(4-cyclobutylphenyl)-2-methylhexan-1-ol
CID 114247193
6-(4-cycloheptylphenyl)-N,6-dihydroxyhexanamide
CID 23503080
2-bromo-1-(4-cyclohexylphenyl)ethanol
CID 116863188
2-amino-1-(4-cyclohexylphenyl)ethanol
CID 82114264
1-(4-cyclohexylphenyl)-N-methylpentan-1-amine
CID 43484983
1-(3-cyclopropylphenyl)decan-1-ol
CID 79980400
1-(3-cyclopropylphenyl)octan-1-ol
CID 79981026

Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclopentylphenyl)hexan-1-ol?
The IUPAC name of 1-(4-cyclopentylphenyl)hexan-1-ol (CID 91233072) is 1-(4-cyclopentylphenyl)hexan-1-ol.
What is the SMILES notation for 1-(4-cyclopentylphenyl)hexan-1-ol?
The canonical SMILES for 1-(4-cyclopentylphenyl)hexan-1-ol is CCCCCC(O)c1ccc(C2CCCC2)cc1.
What is the InChIKey of 1-(4-cyclopentylphenyl)hexan-1-ol?
The InChIKey is UBGBVUJXJGITND-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26O/c1-2-3-4-9-17(18)16-12-10-15(11-13-16)14-7-5-6-8-14/h10-14,17-18H,2-9H2,1H3.
What are the key properties of 1-(4-cyclopentylphenyl)hexan-1-ol?
1-(4-cyclopentylphenyl)hexan-1-ol has a molecular weight of 246.39 g/mol, XLogP of 4.96, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclopentylphenyl)hexan-1-ol is sourced from PubChem (CID 91233072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).