2-(3-hydroxycyclohexyl)cyclohexan-1-ol

C12H22O2 — CID 139824914

IUPAC2-(3-hydroxycyclohexyl)cyclohexan-1-ol
SMILESOC1CCCC(C2CCCCC2O)C1
InChIInChI=1S/C12H22O2/c13-10-5-3-4-9(8-10)11-6-1-2-7-12(11)14/h9-14H,1-8H2
InChIKeyRGOWZBZDYHOJFA-UHFFFAOYSA-N
MW198.31 g/mol
LogP2.09
Rot. Bonds1

About 2-(3-hydroxycyclohexyl)cyclohexan-1-ol

2-(3-hydroxycyclohexyl)cyclohexan-1-ol (PubChem CID 139824914) has the molecular formula C12H22O2 and a molecular weight of 198.31 g/mol. Its IUPAC name is 2-(3-hydroxycyclohexyl)cyclohexan-1-ol.

Molecular Properties

Compound Name2-(3-hydroxycyclohexyl)cyclohexan-1-ol
PubChem CID139824914
Molecular FormulaC12H22O2
Molecular Weight198.31 g/mol
Exact Mass198.16
IUPAC Name2-(3-hydroxycyclohexyl)cyclohexan-1-ol
SMILESOC1CCCC(C2CCCCC2O)C1
InChIInChI=1S/C12H22O2/c13-10-5-3-4-9(8-10)11-6-1-2-7-12(11)14/h9-14H,1-8H2
InChIKeyRGOWZBZDYHOJFA-UHFFFAOYSA-N
XLogP2.09
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(1R)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-ol
CID 54106302
3-(3-hydroxycyclohexyl)cycloheptan-1-ol
CID 129132382
2,3,4,4a,4b,5,6,7,8,8a,9,9a-dodecahydro-1H-fluoren-1-ol
CID 71775317
trans-(1R,3R)-3-cyclopentylcyclohexan-1-ol
CID 66963449
(1R)-2-cyclohexylcyclohexan-1-ol
CID 130125210
2-cyclooctylcyclohexan-1-ol
CID 22359607
(8S,9R,10S,13S,14R)-2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17-hexadecahydro-1H-cyclopenta[a]phenanthren-3-ol
CID 57368410
3-(10-cyclohexyl-1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroanthracen-9-yl)cyclohexan-1-ol;hypobromous acid
CID 142004592
cis-(1S,3R)-3-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]cyclohexan-1-ol
CID 98363893
(1R,4aR,5S,8aS)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-1,5-diol
CID 11907324
1,2,3,4,4a,4b,5,6,7,8,8a,9,10,10a-tetradecahydrophenanthren-1-ol
CID 141104109
2-cyclopentylcyclobutan-1-ol
CID 154017265

Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxycyclohexyl)cyclohexan-1-ol?
The IUPAC name of 2-(3-hydroxycyclohexyl)cyclohexan-1-ol (CID 139824914) is 2-(3-hydroxycyclohexyl)cyclohexan-1-ol.
What is the SMILES notation for 2-(3-hydroxycyclohexyl)cyclohexan-1-ol?
The canonical SMILES for 2-(3-hydroxycyclohexyl)cyclohexan-1-ol is OC1CCCC(C2CCCCC2O)C1.
What is the InChIKey of 2-(3-hydroxycyclohexyl)cyclohexan-1-ol?
The InChIKey is RGOWZBZDYHOJFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22O2/c13-10-5-3-4-9(8-10)11-6-1-2-7-12(11)14/h9-14H,1-8H2.
What are the key properties of 2-(3-hydroxycyclohexyl)cyclohexan-1-ol?
2-(3-hydroxycyclohexyl)cyclohexan-1-ol has a molecular weight of 198.31 g/mol, XLogP of 2.09, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxycyclohexyl)cyclohexan-1-ol is sourced from PubChem (CID 139824914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).