2-(1-ethylimidazol-2-yl)-1-(1-methoxycyclohexyl)ethanol

C14H24N2O2 — CID 116753292

IUPAC2-(1-ethylimidazol-2-yl)-1-(1-methoxycyclohexyl)ethanol
SMILESCCn1ccnc1CC(O)C1(OC)CCCCC1
InChIInChI=1S/C14H24N2O2/c1-3-16-10-9-15-13(16)11-12(17)14(18-2)7-5-4-6-8-14/h9-10,12,17H,3-8,11H2,1-2H3
InChIKeyQLFJAGJAYBYJIX-UHFFFAOYSA-N
MW252.36 g/mol
LogP2.16
Rot. Bonds5

About 2-(1-ethylimidazol-2-yl)-1-(1-methoxycyclohexyl)ethanol

2-(1-ethylimidazol-2-yl)-1-(1-methoxycyclohexyl)ethanol (PubChem CID 116753292) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 2-(1-ethylimidazol-2-yl)-1-(1-methoxycyclohexyl)ethanol.

Molecular Properties

Compound Name2-(1-ethylimidazol-2-yl)-1-(1-methoxycyclohexyl)ethanol
PubChem CID116753292
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name2-(1-ethylimidazol-2-yl)-1-(1-methoxycyclohexyl)ethanol
SMILESCCn1ccnc1CC(O)C1(OC)CCCCC1
InChIInChI=1S/C14H24N2O2/c1-3-16-10-9-15-13(16)11-12(17)14(18-2)7-5-4-6-8-14/h9-10,12,17H,3-8,11H2,1-2H3
InChIKeyQLFJAGJAYBYJIX-UHFFFAOYSA-N
XLogP2.16
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylimidazol-2-yl)-1-(1-methoxycyclohexyl)ethanol?
The IUPAC name of 2-(1-ethylimidazol-2-yl)-1-(1-methoxycyclohexyl)ethanol (CID 116753292) is 2-(1-ethylimidazol-2-yl)-1-(1-methoxycyclohexyl)ethanol.
What is the SMILES notation for 2-(1-ethylimidazol-2-yl)-1-(1-methoxycyclohexyl)ethanol?
The canonical SMILES for 2-(1-ethylimidazol-2-yl)-1-(1-methoxycyclohexyl)ethanol is CCn1ccnc1CC(O)C1(OC)CCCCC1.
What is the InChIKey of 2-(1-ethylimidazol-2-yl)-1-(1-methoxycyclohexyl)ethanol?
The InChIKey is QLFJAGJAYBYJIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-3-16-10-9-15-13(16)11-12(17)14(18-2)7-5-4-6-8-14/h9-10,12,17H,3-8,11H2,1-2H3.
What are the key properties of 2-(1-ethylimidazol-2-yl)-1-(1-methoxycyclohexyl)ethanol?
2-(1-ethylimidazol-2-yl)-1-(1-methoxycyclohexyl)ethanol has a molecular weight of 252.36 g/mol, XLogP of 2.16, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylimidazol-2-yl)-1-(1-methoxycyclohexyl)ethanol is sourced from PubChem (CID 116753292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).