1-ethyl-7-(2-methoxyphenyl)-2-methylbenzimidazole

C17H18N2O — CID 123988066

IUPAC1-ethyl-7-(2-methoxyphenyl)-2-methylbenzimidazole
SMILESCCn1c(C)nc2cccc(-c3ccccc3OC)c21
InChIInChI=1S/C17H18N2O/c1-4-19-12(2)18-15-10-7-9-14(17(15)19)13-8-5-6-11-16(13)20-3/h5-11H,4H2,1-3H3
InChIKeyGXOYGRYOXDYOFP-UHFFFAOYSA-N
MW266.34 g/mol
LogP4.04
Rot. Bonds3

About 1-ethyl-7-(2-methoxyphenyl)-2-methylbenzimidazole

1-ethyl-7-(2-methoxyphenyl)-2-methylbenzimidazole (PubChem CID 123988066) has the molecular formula C17H18N2O and a molecular weight of 266.34 g/mol. Its IUPAC name is 1-ethyl-7-(2-methoxyphenyl)-2-methylbenzimidazole.

Molecular Properties

Compound Name1-ethyl-7-(2-methoxyphenyl)-2-methylbenzimidazole
PubChem CID123988066
Molecular FormulaC17H18N2O
Molecular Weight266.34 g/mol
Exact Mass266.14
IUPAC Name1-ethyl-7-(2-methoxyphenyl)-2-methylbenzimidazole
SMILESCCn1c(C)nc2cccc(-c3ccccc3OC)c21
InChIInChI=1S/C17H18N2O/c1-4-19-12(2)18-15-10-7-9-14(17(15)19)13-8-5-6-11-16(13)20-3/h5-11H,4H2,1-3H3
InChIKeyGXOYGRYOXDYOFP-UHFFFAOYSA-N
XLogP4.04
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-ethyl-2-methylbenzimidazol-4-yl)-3-(5-fluoro-2-methoxyphenyl)thiourea
CID 86665456
4-ethyl-3-(2-methoxyphenyl)-1H-1,2,4-triazole-5-thione
CID 748123
7-methoxy-2-methyl-1-(4,4,4-trifluorobutyl)benzimidazole
CID 163275937
1-[(2-methoxyphenyl)methyl]-2-methylbenzimidazole
CID 940002
N,4-diethyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-amine
CID 112596812
3-[[5-(2,3-dimethoxyphenyl)-1,2,4-oxadiazol-3-yl]methyl]-2-methylquinazolin-4-one
CID 53060174
1-[2-(2-methoxyphenyl)phenyl]naphthalene
CID 175027379
3-ethyl-2-[[2-(2-methoxyphenyl)imidazol-1-yl]methyl]imidazo[4,5-b]pyridine
CID 22380033
2-[[4-ethyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzothiazole
CID 4800149
6,7-dichloro-1-ethyl-2-methylbenzimidazole
CID 154116505
4-ethyl-3-(2-methoxyphenyl)-5-(2-methylpropylsulfanyl)-1,2,4-triazole
CID 47095919
4-[2-(2-methoxyphenyl)benzimidazol-1-yl]butan-1-amine
CID 82144688

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-7-(2-methoxyphenyl)-2-methylbenzimidazole?
The IUPAC name of 1-ethyl-7-(2-methoxyphenyl)-2-methylbenzimidazole (CID 123988066) is 1-ethyl-7-(2-methoxyphenyl)-2-methylbenzimidazole.
What is the SMILES notation for 1-ethyl-7-(2-methoxyphenyl)-2-methylbenzimidazole?
The canonical SMILES for 1-ethyl-7-(2-methoxyphenyl)-2-methylbenzimidazole is CCn1c(C)nc2cccc(-c3ccccc3OC)c21.
What is the InChIKey of 1-ethyl-7-(2-methoxyphenyl)-2-methylbenzimidazole?
The InChIKey is GXOYGRYOXDYOFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O/c1-4-19-12(2)18-15-10-7-9-14(17(15)19)13-8-5-6-11-16(13)20-3/h5-11H,4H2,1-3H3.
What are the key properties of 1-ethyl-7-(2-methoxyphenyl)-2-methylbenzimidazole?
1-ethyl-7-(2-methoxyphenyl)-2-methylbenzimidazole has a molecular weight of 266.34 g/mol, XLogP of 4.04, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-7-(2-methoxyphenyl)-2-methylbenzimidazole is sourced from PubChem (CID 123988066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).