1-ethyl-2-(1-phenoxyethyl)benzimidazole

C17H18N2O — CID 2984876

IUPAC1-ethyl-2-(1-phenoxyethyl)benzimidazole
SMILESCCn1c(C(C)Oc2ccccc2)nc2ccccc21
InChIInChI=1S/C17H18N2O/c1-3-19-16-12-8-7-11-15(16)18-17(19)13(2)20-14-9-5-4-6-10-14/h4-13H,3H2,1-2H3
InChIKeyOXCQCDDVQJSERR-UHFFFAOYSA-N
MW266.34 g/mol
LogP4.20
Rot. Bonds4

About 1-ethyl-2-(1-phenoxyethyl)benzimidazole

1-ethyl-2-(1-phenoxyethyl)benzimidazole (PubChem CID 2984876) has the molecular formula C17H18N2O and a molecular weight of 266.34 g/mol. Its IUPAC name is 1-ethyl-2-(1-phenoxyethyl)benzimidazole.

Molecular Properties

Compound Name1-ethyl-2-(1-phenoxyethyl)benzimidazole
PubChem CID2984876
Molecular FormulaC17H18N2O
Molecular Weight266.34 g/mol
Exact Mass266.14
IUPAC Name1-ethyl-2-(1-phenoxyethyl)benzimidazole
SMILESCCn1c(C(C)Oc2ccccc2)nc2ccccc21
InChIInChI=1S/C17H18N2O/c1-3-19-16-12-8-7-11-15(16)18-17(19)13(2)20-14-9-5-4-6-10-14/h4-13H,3H2,1-2H3
InChIKeyOXCQCDDVQJSERR-UHFFFAOYSA-N
XLogP4.20
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(1R)-1-phenoxyethyl]-1-(2-phenoxyethyl)benzimidazole
CID 7574593
1-ethyl-2-propan-2-ylbenzimidazole
CID 962427
1-[(2-fluorophenyl)methyl]-2-(1-phenoxyethyl)benzimidazole
CID 18877735
propan-2-yl 2-[2-(1-phenoxyethyl)benzimidazol-1-yl]acetate
CID 16998895
1-[2-(3,5-dimethylphenoxy)ethyl]-2-(1-phenoxyethyl)benzimidazole
CID 16998835
N-methyl-2-[2-(1-phenoxyethyl)benzimidazol-1-yl]-N-phenylacetamide
CID 16998881
2-[1-(4-chlorophenoxy)ethyl]-1-(2-ethoxyethyl)benzimidazole
CID 16999033
1-butyl-2-[1-(3-methylphenoxy)ethyl]benzimidazole
CID 18877810
2-[1-(3-methylphenoxy)ethyl]-1-nonylbenzimidazole
CID 18877805
[(1-ethylbenzimidazol-2-yl)-(trimethyl-λ4-sulfanyl)methyl]-trimethyl-λ4-sulfane
CID 89375402
(S)-(1-ethylbenzimidazol-2-yl)-(4-methoxyphenyl)methanol
CID 914008
1-[2-(1-phenoxyethyl)benzimidazol-1-yl]-3-(thiophen-2-ylmethoxy)propan-2-ol
CID 42933902

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2-(1-phenoxyethyl)benzimidazole?
The IUPAC name of 1-ethyl-2-(1-phenoxyethyl)benzimidazole (CID 2984876) is 1-ethyl-2-(1-phenoxyethyl)benzimidazole.
What is the SMILES notation for 1-ethyl-2-(1-phenoxyethyl)benzimidazole?
The canonical SMILES for 1-ethyl-2-(1-phenoxyethyl)benzimidazole is CCn1c(C(C)Oc2ccccc2)nc2ccccc21.
What is the InChIKey of 1-ethyl-2-(1-phenoxyethyl)benzimidazole?
The InChIKey is OXCQCDDVQJSERR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O/c1-3-19-16-12-8-7-11-15(16)18-17(19)13(2)20-14-9-5-4-6-10-14/h4-13H,3H2,1-2H3.
What are the key properties of 1-ethyl-2-(1-phenoxyethyl)benzimidazole?
1-ethyl-2-(1-phenoxyethyl)benzimidazole has a molecular weight of 266.34 g/mol, XLogP of 4.20, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2-(1-phenoxyethyl)benzimidazole is sourced from PubChem (CID 2984876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).