[(1R,2R)-2-ethylcyclohexyl]methanol

C9H18O — CID 58154483

IUPAC[(1R,2R)-2-ethylcyclohexyl]methanol
SMILESCC[C@@H]1CCCC[C@H]1CO
InChIInChI=1S/C9H18O/c1-2-8-5-3-4-6-9(8)7-10/h8-10H,2-7H2,1H3/t8-,9+/m1/s1
InChIKeyPFQQPJMDCDHXJZ-BDAKNGLRSA-N
MW142.24 g/mol
LogP2.20
Rot. Bonds2

About [(1R,2R)-2-ethylcyclohexyl]methanol

[(1R,2R)-2-ethylcyclohexyl]methanol (PubChem CID 58154483) has the molecular formula C9H18O and a molecular weight of 142.24 g/mol. Its IUPAC name is [(1R,2R)-2-ethylcyclohexyl]methanol.

Molecular Properties

Compound Name[(1R,2R)-2-ethylcyclohexyl]methanol
PubChem CID58154483
Molecular FormulaC9H18O
Molecular Weight142.24 g/mol
Exact Mass142.14
IUPAC Name[(1R,2R)-2-ethylcyclohexyl]methanol
SMILESCC[C@@H]1CCCC[C@H]1CO
InChIInChI=1S/C9H18O/c1-2-8-5-3-4-6-9(8)7-10/h8-10H,2-7H2,1H3/t8-,9+/m1/s1
InChIKeyPFQQPJMDCDHXJZ-BDAKNGLRSA-N
XLogP2.20
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.24
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze [(1R,2R)-2-ethylcyclohexyl]methanol 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

3,7-Dimethyl-1-octanol
CID 7792
2-Butyl-1-octanol
CID 19800
4-Methylcyclohexanemethanol
CID 118193
3,4-Dimethylcyclohexanol
CID 97960
2-Cyclohexylethanol
CID 20508
p-Menthan-7-ol
CID 83763
1-Cyclohexylethanol
CID 137829
2-Propyl-1-heptanol
CID 24847
2-Propylcyclohexan-1-ol
CID 138614
alpha-Methylcyclohexanepropanol
CID 112065
2-Cyclododecylpropan-1-ol
CID 9815980
4-Ethylcyclohexanol
CID 78293

Frequently Asked Questions

What is the IUPAC name of [(1R,2R)-2-ethylcyclohexyl]methanol?
The IUPAC name of [(1R,2R)-2-ethylcyclohexyl]methanol (CID 58154483) is [(1R,2R)-2-ethylcyclohexyl]methanol.
What is the SMILES notation for [(1R,2R)-2-ethylcyclohexyl]methanol?
The canonical SMILES for [(1R,2R)-2-ethylcyclohexyl]methanol is CC[C@@H]1CCCC[C@H]1CO.
What is the InChIKey of [(1R,2R)-2-ethylcyclohexyl]methanol?
The InChIKey is PFQQPJMDCDHXJZ-BDAKNGLRSA-N. The full InChI is InChI=1S/C9H18O/c1-2-8-5-3-4-6-9(8)7-10/h8-10H,2-7H2,1H3/t8-,9+/m1/s1.
What are the key properties of [(1R,2R)-2-ethylcyclohexyl]methanol?
[(1R,2R)-2-ethylcyclohexyl]methanol has a molecular weight of 142.24 g/mol, XLogP of 2.20, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,2R)-2-ethylcyclohexyl]methanol is sourced from PubChem (CID 58154483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).