2-methoxyethoxycyclohexane

C9H18O2 — CID 20550469

IUPAC2-methoxyethoxycyclohexane
SMILESCOCCOC1CCCCC1
InChIInChI=1S/C9H18O2/c1-10-7-8-11-9-5-3-2-4-6-9/h9H,2-8H2,1H3
InChIKeyVELIPZRRTDLWMZ-UHFFFAOYSA-N
MW158.24 g/mol
LogP1.98
Rot. Bonds4

About 2-methoxyethoxycyclohexane

2-methoxyethoxycyclohexane (PubChem CID 20550469) has the molecular formula C9H18O2 and a molecular weight of 158.24 g/mol. Its IUPAC name is 2-methoxyethoxycyclohexane.

Molecular Properties

Compound Name2-methoxyethoxycyclohexane
PubChem CID20550469
Molecular FormulaC9H18O2
Molecular Weight158.24 g/mol
Exact Mass158.13
IUPAC Name2-methoxyethoxycyclohexane
SMILESCOCCOC1CCCCC1
InChIInChI=1S/C9H18O2/c1-10-7-8-11-9-5-3-2-4-6-9/h9H,2-8H2,1H3
InChIKeyVELIPZRRTDLWMZ-UHFFFAOYSA-N
XLogP1.98
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-methoxypropoxycyclooctane
CID 68608033
N-(2-cyclopentyloxyethyl)-2-methoxyethanamine
CID 62564778
propoxycyclooctane
CID 54078990
N-(2-cyclohexyloxyethyl)-3-methoxypropan-1-amine
CID 62567637
8-cycloheptyloxyoctoxycycloheptane
CID 173292672
bis(2-cyclohexyloxyethyl) carbonate
CID 139670101
trans-(1R,3R)-3-(2-methoxyethoxy)cyclohexan-1-amine
CID 156885950
1-(2-cyclohexyloxyethyl)-3-(2-methoxyethyl)thiourea
CID 115588050
(3R)-3-(2-methoxyethoxy)-1-methylpiperidine
CID 59007577
1-bromo-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]cycloheptane
CID 104565568
1-(2,2-dimethylpropyl)-4-(2-methoxyethoxy)cyclohexane
CID 167076241
2-cyclohexyloxyethyl 2-methylprop-2-enoate
CID 14692693

Frequently Asked Questions

What is the IUPAC name of 2-methoxyethoxycyclohexane?
The IUPAC name of 2-methoxyethoxycyclohexane (CID 20550469) is 2-methoxyethoxycyclohexane.
What is the SMILES notation for 2-methoxyethoxycyclohexane?
The canonical SMILES for 2-methoxyethoxycyclohexane is COCCOC1CCCCC1.
What is the InChIKey of 2-methoxyethoxycyclohexane?
The InChIKey is VELIPZRRTDLWMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18O2/c1-10-7-8-11-9-5-3-2-4-6-9/h9H,2-8H2,1H3.
What are the key properties of 2-methoxyethoxycyclohexane?
2-methoxyethoxycyclohexane has a molecular weight of 158.24 g/mol, XLogP of 1.98, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxyethoxycyclohexane is sourced from PubChem (CID 20550469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).