2-[(3R)-1-(2-hydroxyethyl)-3-methylcyclohexyl]ethanol

C11H22O2 — CID 168973967

IUPAC2-[(3R)-1-(2-hydroxyethyl)-3-methylcyclohexyl]ethanol
SMILESC[C@@H]1CCCC(CCO)(CCO)C1
InChIInChI=1S/C11H22O2/c1-10-3-2-4-11(9-10,5-7-12)6-8-13/h10,12-13H,2-9H2,1H3/t10-/m1/s1
InChIKeyNNIXTZXSQYLSQK-SNVBAGLBSA-N
MW186.29 g/mol
LogP1.95
Rot. Bonds4

About 2-[(3R)-1-(2-hydroxyethyl)-3-methylcyclohexyl]ethanol

2-[(3R)-1-(2-hydroxyethyl)-3-methylcyclohexyl]ethanol (PubChem CID 168973967) has the molecular formula C11H22O2 and a molecular weight of 186.29 g/mol. Its IUPAC name is 2-[(3R)-1-(2-hydroxyethyl)-3-methylcyclohexyl]ethanol.

Molecular Properties

Compound Name2-[(3R)-1-(2-hydroxyethyl)-3-methylcyclohexyl]ethanol
PubChem CID168973967
Molecular FormulaC11H22O2
Molecular Weight186.29 g/mol
Exact Mass186.16
IUPAC Name2-[(3R)-1-(2-hydroxyethyl)-3-methylcyclohexyl]ethanol
SMILESC[C@@H]1CCCC(CCO)(CCO)C1
InChIInChI=1S/C11H22O2/c1-10-3-2-4-11(9-10,5-7-12)6-8-13/h10,12-13H,2-9H2,1H3/t10-/m1/s1
InChIKeyNNIXTZXSQYLSQK-SNVBAGLBSA-N
XLogP1.95
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.29
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-[(3R)-1-(2-hydroxyethyl)-3-methylcyclohexyl]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,1-diethyl-3-methylcyclohexane
CID 19090157
methyl 2-[1-(2-methoxy-2-oxoethyl)-3-methylcyclohexyl]acetate
CID 101326115
[(3R)-1-(acetyloxymethyl)-3-methylcyclohexyl]methyl acetate
CID 168973953
1-[1-(aminomethyl)-3-methylcyclohexyl]-2-methylcyclopentan-1-ol
CID 79123958
2-[1-(2-hydroxyethyl)cyclononadecyl]ethanol
CID 150954870
2-[1-(2-hydroxyethyl)cyclodecyl]ethanol
CID 18618783
2-[2,2-difluoroethyl-[[1-(hydroxymethyl)-3-methylcyclohexyl]methyl]amino]ethanol
CID 107487176
2-[1-(aminomethyl)-3-methylcyclohexyl]acetic acid;hydrochloride
CID 45260252
(1-hexyl-3-methylcyclohexyl)methanamine
CID 65394877
[1-[[3-(diethylamino)propyl-ethylamino]methyl]-3-methylcyclohexyl]methanol
CID 102997292
[1-[[bis(3-methylbutyl)amino]methyl]-3-methylcyclohexyl]methanol
CID 107871199
2-[cyclobutyl-[[3-methyl-1-[(propan-2-ylamino)methyl]cyclohexyl]methyl]amino]ethanol
CID 102871050

Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-1-(2-hydroxyethyl)-3-methylcyclohexyl]ethanol?
The IUPAC name of 2-[(3R)-1-(2-hydroxyethyl)-3-methylcyclohexyl]ethanol (CID 168973967) is 2-[(3R)-1-(2-hydroxyethyl)-3-methylcyclohexyl]ethanol.
What is the SMILES notation for 2-[(3R)-1-(2-hydroxyethyl)-3-methylcyclohexyl]ethanol?
The canonical SMILES for 2-[(3R)-1-(2-hydroxyethyl)-3-methylcyclohexyl]ethanol is C[C@@H]1CCCC(CCO)(CCO)C1.
What is the InChIKey of 2-[(3R)-1-(2-hydroxyethyl)-3-methylcyclohexyl]ethanol?
The InChIKey is NNIXTZXSQYLSQK-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H22O2/c1-10-3-2-4-11(9-10,5-7-12)6-8-13/h10,12-13H,2-9H2,1H3/t10-/m1/s1.
What are the key properties of 2-[(3R)-1-(2-hydroxyethyl)-3-methylcyclohexyl]ethanol?
2-[(3R)-1-(2-hydroxyethyl)-3-methylcyclohexyl]ethanol has a molecular weight of 186.29 g/mol, XLogP of 1.95, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-1-(2-hydroxyethyl)-3-methylcyclohexyl]ethanol is sourced from PubChem (CID 168973967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).