1-cyclohexyl-2-(3-hydroxypropyl)cyclohexan-1-ol

C15H28O2 — CID 156755741

IUPAC1-cyclohexyl-2-(3-hydroxypropyl)cyclohexan-1-ol
SMILESOCCCC1CCCCC1(O)C1CCCCC1
InChIInChI=1S/C15H28O2/c16-12-6-10-14-9-4-5-11-15(14,17)13-7-2-1-3-8-13/h13-14,16-17H,1-12H2
InChIKeyZGKLFCNKTATBQG-UHFFFAOYSA-N
MW240.39 g/mol
LogP3.26
Rot. Bonds4

About 1-cyclohexyl-2-(3-hydroxypropyl)cyclohexan-1-ol

1-cyclohexyl-2-(3-hydroxypropyl)cyclohexan-1-ol (PubChem CID 156755741) has the molecular formula C15H28O2 and a molecular weight of 240.39 g/mol. Its IUPAC name is 1-cyclohexyl-2-(3-hydroxypropyl)cyclohexan-1-ol.

Molecular Properties

Compound Name1-cyclohexyl-2-(3-hydroxypropyl)cyclohexan-1-ol
PubChem CID156755741
Molecular FormulaC15H28O2
Molecular Weight240.39 g/mol
Exact Mass240.21
IUPAC Name1-cyclohexyl-2-(3-hydroxypropyl)cyclohexan-1-ol
SMILESOCCCC1CCCCC1(O)C1CCCCC1
InChIInChI=1S/C15H28O2/c16-12-6-10-14-9-4-5-11-15(14,17)13-7-2-1-3-8-13/h13-14,16-17H,1-12H2
InChIKeyZGKLFCNKTATBQG-UHFFFAOYSA-N
XLogP3.26
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 53.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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2-ethyl-1-(4-ethylcyclohexyl)cyclohexan-1-ol
CID 64748782
2-ethyl-1-(4-methylcyclohexyl)cyclohexan-1-ol
CID 64749951
2-[2,2-bis(2-hydroxyethyl)cyclopentacosyl]ethanol
CID 150682925
[2-butyl-1-(hydroxymethyl)cyclohexyl]methanol
CID 18784276
trans-(1S,2S)-2-cyclohexyl-2-hydroxycyclohexane-1-carboxylic acid
CID 102532516
1-cycloheptyl-2-propylcyclopropan-1-ol
CID 79333656
2-(1-cyclohexylcyclohexyl)ethanol
CID 174399046
(3aS)-1,2,3,4,5,6,7,7a-octahydroinden-3a-ol
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CID 130150685

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2-(3-hydroxypropyl)cyclohexan-1-ol?
The IUPAC name of 1-cyclohexyl-2-(3-hydroxypropyl)cyclohexan-1-ol (CID 156755741) is 1-cyclohexyl-2-(3-hydroxypropyl)cyclohexan-1-ol.
What is the SMILES notation for 1-cyclohexyl-2-(3-hydroxypropyl)cyclohexan-1-ol?
The canonical SMILES for 1-cyclohexyl-2-(3-hydroxypropyl)cyclohexan-1-ol is OCCCC1CCCCC1(O)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-2-(3-hydroxypropyl)cyclohexan-1-ol?
The InChIKey is ZGKLFCNKTATBQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28O2/c16-12-6-10-14-9-4-5-11-15(14,17)13-7-2-1-3-8-13/h13-14,16-17H,1-12H2.
What are the key properties of 1-cyclohexyl-2-(3-hydroxypropyl)cyclohexan-1-ol?
1-cyclohexyl-2-(3-hydroxypropyl)cyclohexan-1-ol has a molecular weight of 240.39 g/mol, XLogP of 3.26, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-(3-hydroxypropyl)cyclohexan-1-ol is sourced from PubChem (CID 156755741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).