1-(2-methoxycyclohexyl)ethanol

C9H18O2 — CID 106874670

IUPAC1-(2-methoxycyclohexyl)ethanol
SMILESCOC1CCCCC1C(C)O
InChIInChI=1S/C9H18O2/c1-7(10)8-5-3-4-6-9(8)11-2/h7-10H,3-6H2,1-2H3
InChIKeyPSMXBZOHLFZRCD-UHFFFAOYSA-N
MW158.24 g/mol
LogP1.57
Rot. Bonds2

About 1-(2-methoxycyclohexyl)ethanol

1-(2-methoxycyclohexyl)ethanol (PubChem CID 106874670) has the molecular formula C9H18O2 and a molecular weight of 158.24 g/mol. Its IUPAC name is 1-(2-methoxycyclohexyl)ethanol.

Molecular Properties

Compound Name1-(2-methoxycyclohexyl)ethanol
PubChem CID106874670
Molecular FormulaC9H18O2
Molecular Weight158.24 g/mol
Exact Mass158.13
IUPAC Name1-(2-methoxycyclohexyl)ethanol
SMILESCOC1CCCCC1C(C)O
InChIInChI=1S/C9H18O2/c1-7(10)8-5-3-4-6-9(8)11-2/h7-10H,3-6H2,1-2H3
InChIKeyPSMXBZOHLFZRCD-UHFFFAOYSA-N
XLogP1.57
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

cis-(1R,2R)-1-methoxy-2-propan-2-ylcyclopentane
CID 137449477
(2S)-2-methoxycyclohexan-1-ol
CID 11105391
2-methoxy-6-propan-2-ylcyclohexan-1-ol
CID 140573404
2-(1-hydroxyethyl)cyclodecan-1-ol
CID 23443021
N-ethyl-1-(2-methoxycyclohexyl)-2-methylpropan-1-amine
CID 106874658
trans-(1S,2S)-1-methoxy-2-propan-2-yloxycyclohexane
CID 134594695
trans-(1R,2R)-1-methoxy-2-propan-2-yloxycyclohexane
CID 126735216
1-(2-aminocyclononyl)ethanol
CID 123398875
4-[(1R)-1-hydroxyethyl]-3-methoxypiperidine-1-carbonitrile
CID 87111631
cis-(1R,2S)-1,2-dimethoxycyclopentane
CID 21122335
(2R)-1-[(2-methoxycyclopentyl)amino]propan-2-ol
CID 106932046
(3R)-3-[(1S)-1-hydroxyethyl]-N-[(1S,2R)-2-methoxycycloheptyl]pyrrolidine-1-carboxamide
CID 124845632

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxycyclohexyl)ethanol?
The IUPAC name of 1-(2-methoxycyclohexyl)ethanol (CID 106874670) is 1-(2-methoxycyclohexyl)ethanol.
What is the SMILES notation for 1-(2-methoxycyclohexyl)ethanol?
The canonical SMILES for 1-(2-methoxycyclohexyl)ethanol is COC1CCCCC1C(C)O.
What is the InChIKey of 1-(2-methoxycyclohexyl)ethanol?
The InChIKey is PSMXBZOHLFZRCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18O2/c1-7(10)8-5-3-4-6-9(8)11-2/h7-10H,3-6H2,1-2H3.
What are the key properties of 1-(2-methoxycyclohexyl)ethanol?
1-(2-methoxycyclohexyl)ethanol has a molecular weight of 158.24 g/mol, XLogP of 1.57, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxycyclohexyl)ethanol is sourced from PubChem (CID 106874670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).