2-(1-ethylimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol

C14H24N2O — CID 79743980

IUPAC2-(1-ethylimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol
SMILESCCn1ccnc1CC(O)C1CCCC(C)C1
InChIInChI=1S/C14H24N2O/c1-3-16-8-7-15-14(16)10-13(17)12-6-4-5-11(2)9-12/h7-8,11-13,17H,3-6,9-10H2,1-2H3
InChIKeyAJGUSOBLSRJJML-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.63
Rot. Bonds4

About 2-(1-ethylimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol

2-(1-ethylimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol (PubChem CID 79743980) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 2-(1-ethylimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol.

Molecular Properties

Compound Name2-(1-ethylimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol
PubChem CID79743980
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name2-(1-ethylimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol
SMILESCCn1ccnc1CC(O)C1CCCC(C)C1
InChIInChI=1S/C14H24N2O/c1-3-16-8-7-15-14(16)10-13(17)12-6-4-5-11(2)9-12/h7-8,11-13,17H,3-6,9-10H2,1-2H3
InChIKeyAJGUSOBLSRJJML-UHFFFAOYSA-N
XLogP2.63
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol?
The IUPAC name of 2-(1-ethylimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol (CID 79743980) is 2-(1-ethylimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol.
What is the SMILES notation for 2-(1-ethylimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol?
The canonical SMILES for 2-(1-ethylimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol is CCn1ccnc1CC(O)C1CCCC(C)C1.
What is the InChIKey of 2-(1-ethylimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol?
The InChIKey is AJGUSOBLSRJJML-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-3-16-8-7-15-14(16)10-13(17)12-6-4-5-11(2)9-12/h7-8,11-13,17H,3-6,9-10H2,1-2H3.
What are the key properties of 2-(1-ethylimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol?
2-(1-ethylimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol has a molecular weight of 236.36 g/mol, XLogP of 2.63, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol is sourced from PubChem (CID 79743980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).