2-(2-cyclohexyl-2-hydroxyethyl)bicyclo[2.1.1]hexan-1-ol

C14H24O2 — CID 102532442

IUPAC2-(2-cyclohexyl-2-hydroxyethyl)bicyclo[2.1.1]hexan-1-ol
SMILESOC(CC1CC2CC1(O)C2)C1CCCCC1
InChIInChI=1S/C14H24O2/c15-13(11-4-2-1-3-5-11)7-12-6-10-8-14(12,16)9-10/h10-13,15-16H,1-9H2
InChIKeyPYGZUKZPPAKEAJ-UHFFFAOYSA-N
MW224.34 g/mol
LogP2.48
Rot. Bonds3

About 2-(2-cyclohexyl-2-hydroxyethyl)bicyclo[2.1.1]hexan-1-ol

2-(2-cyclohexyl-2-hydroxyethyl)bicyclo[2.1.1]hexan-1-ol (PubChem CID 102532442) has the molecular formula C14H24O2 and a molecular weight of 224.34 g/mol. Its IUPAC name is 2-(2-cyclohexyl-2-hydroxyethyl)bicyclo[2.1.1]hexan-1-ol.

Molecular Properties

Compound Name2-(2-cyclohexyl-2-hydroxyethyl)bicyclo[2.1.1]hexan-1-ol
PubChem CID102532442
Molecular FormulaC14H24O2
Molecular Weight224.34 g/mol
Exact Mass224.18
IUPAC Name2-(2-cyclohexyl-2-hydroxyethyl)bicyclo[2.1.1]hexan-1-ol
SMILESOC(CC1CC2CC1(O)C2)C1CCCCC1
InChIInChI=1S/C14H24O2/c15-13(11-4-2-1-3-5-11)7-12-6-10-8-14(12,16)9-10/h10-13,15-16H,1-9H2
InChIKeyPYGZUKZPPAKEAJ-UHFFFAOYSA-N
XLogP2.48
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.34
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclohexyl-2-hydroxyethyl)bicyclo[2.1.1]hexan-1-ol?
The IUPAC name of 2-(2-cyclohexyl-2-hydroxyethyl)bicyclo[2.1.1]hexan-1-ol (CID 102532442) is 2-(2-cyclohexyl-2-hydroxyethyl)bicyclo[2.1.1]hexan-1-ol.
What is the SMILES notation for 2-(2-cyclohexyl-2-hydroxyethyl)bicyclo[2.1.1]hexan-1-ol?
The canonical SMILES for 2-(2-cyclohexyl-2-hydroxyethyl)bicyclo[2.1.1]hexan-1-ol is OC(CC1CC2CC1(O)C2)C1CCCCC1.
What is the InChIKey of 2-(2-cyclohexyl-2-hydroxyethyl)bicyclo[2.1.1]hexan-1-ol?
The InChIKey is PYGZUKZPPAKEAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O2/c15-13(11-4-2-1-3-5-11)7-12-6-10-8-14(12,16)9-10/h10-13,15-16H,1-9H2.
What are the key properties of 2-(2-cyclohexyl-2-hydroxyethyl)bicyclo[2.1.1]hexan-1-ol?
2-(2-cyclohexyl-2-hydroxyethyl)bicyclo[2.1.1]hexan-1-ol has a molecular weight of 224.34 g/mol, XLogP of 2.48, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclohexyl-2-hydroxyethyl)bicyclo[2.1.1]hexan-1-ol is sourced from PubChem (CID 102532442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).