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

C18H26N2O — CID 79755078

IUPAC2-(1-ethylbenzimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol
SMILESCCn1c(CC(O)C2CCCC(C)C2)nc2ccccc21
InChIInChI=1S/C18H26N2O/c1-3-20-16-10-5-4-9-15(16)19-18(20)12-17(21)14-8-6-7-13(2)11-14/h4-5,9-10,13-14,17,21H,3,6-8,11-12H2,1-2H3
InChIKeyHPDUTVOKLZFYQU-UHFFFAOYSA-N
MW286.42 g/mol
LogP3.79
Rot. Bonds4

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

2-(1-ethylbenzimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol (PubChem CID 79755078) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is 2-(1-ethylbenzimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol.

Molecular Properties

Compound Name2-(1-ethylbenzimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol
PubChem CID79755078
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC Name2-(1-ethylbenzimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol
SMILESCCn1c(CC(O)C2CCCC(C)C2)nc2ccccc21
InChIInChI=1S/C18H26N2O/c1-3-20-16-10-5-4-9-15(16)19-18(20)12-17(21)14-8-6-7-13(2)11-14/h4-5,9-10,13-14,17,21H,3,6-8,11-12H2,1-2H3
InChIKeyHPDUTVOKLZFYQU-UHFFFAOYSA-N
XLogP3.79
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-ethylbenzimidazol-2-yl)-1-(oxan-4-yl)ethanol
CID 79753249
1-cyclobutyl-2-(1-ethylbenzimidazol-2-yl)-N-methylethanamine
CID 79750551
2-(1-ethylbenzimidazol-2-yl)-1-(thiolan-2-yl)ethanol
CID 80622777
1-(1-ethylbenzimidazol-2-yl)propan-2-ol
CID 79753828
1-(3-bicyclo[3.1.0]hexanyl)-2-(1-propylbenzimidazol-2-yl)ethanol
CID 115818146
1-(3-methylcyclopentyl)-2-(1-propylbenzimidazol-2-yl)ethanamine
CID 79757049
1-(6-bicyclo[3.1.0]hexanyl)-2-(1-propylbenzimidazol-2-yl)ethanol
CID 115818131
N-[(1-ethylbenzimidazol-2-yl)methyl]-1-(3-methylcyclopentyl)methanamine
CID 107411845
1,1-diethoxy-3-(1-ethylbenzimidazol-2-yl)propan-2-ol
CID 79756098
1-cyclobutyl-3-(1-propylbenzimidazol-2-yl)propan-2-ol
CID 103170121
2-[(1-ethylbenzimidazol-2-yl)methyl]cyclopentan-1-ol
CID 79750335
2-(1-ethylbenzimidazol-2-yl)-1-(1-methylcyclohexyl)ethanol
CID 106830947

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylbenzimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol?
The IUPAC name of 2-(1-ethylbenzimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol (CID 79755078) is 2-(1-ethylbenzimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol.
What is the SMILES notation for 2-(1-ethylbenzimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol?
The canonical SMILES for 2-(1-ethylbenzimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol is CCn1c(CC(O)C2CCCC(C)C2)nc2ccccc21.
What is the InChIKey of 2-(1-ethylbenzimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol?
The InChIKey is HPDUTVOKLZFYQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c1-3-20-16-10-5-4-9-15(16)19-18(20)12-17(21)14-8-6-7-13(2)11-14/h4-5,9-10,13-14,17,21H,3,6-8,11-12H2,1-2H3.
What are the key properties of 2-(1-ethylbenzimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol?
2-(1-ethylbenzimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol has a molecular weight of 286.42 g/mol, XLogP of 3.79, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylbenzimidazol-2-yl)-1-(3-methylcyclohexyl)ethanol is sourced from PubChem (CID 79755078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).