6,7-dichloro-1-ethyl-2-methylbenzimidazole

C10H10Cl2N2 — CID 154116505

IUPAC6,7-dichloro-1-ethyl-2-methylbenzimidazole
SMILESCCn1c(C)nc2ccc(Cl)c(Cl)c21
InChIInChI=1S/C10H10Cl2N2/c1-3-14-6(2)13-8-5-4-7(11)9(12)10(8)14/h4-5H,3H2,1-2H3
InChIKeyZLBNRKUMZNRYQD-UHFFFAOYSA-N
MW229.11 g/mol
LogP3.67
Rot. Bonds1

About 6,7-dichloro-1-ethyl-2-methylbenzimidazole

6,7-dichloro-1-ethyl-2-methylbenzimidazole (PubChem CID 154116505) has the molecular formula C10H10Cl2N2 and a molecular weight of 229.11 g/mol. Its IUPAC name is 6,7-dichloro-1-ethyl-2-methylbenzimidazole.

Molecular Properties

Compound Name6,7-dichloro-1-ethyl-2-methylbenzimidazole
PubChem CID154116505
Molecular FormulaC10H10Cl2N2
Molecular Weight229.11 g/mol
Exact Mass228.02
IUPAC Name6,7-dichloro-1-ethyl-2-methylbenzimidazole
SMILESCCn1c(C)nc2ccc(Cl)c(Cl)c21
InChIInChI=1S/C10H10Cl2N2/c1-3-14-6(2)13-8-5-4-7(11)9(12)10(8)14/h4-5H,3H2,1-2H3
InChIKeyZLBNRKUMZNRYQD-UHFFFAOYSA-N
XLogP3.67
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.11
LogP ≤ 53.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-ethyl-7-(2-methoxyphenyl)-2-methylbenzimidazole
CID 123988066
1-ethyl-2-methylimidazo[4,5-c]pyridine
CID 147300637
3-ethyl-2-methylimidazo[4,5-b]pyridine
CID 23298284
2-(7-chloro-1-ethylbenzimidazol-2-yl)-N-methylpropan-2-amine
CID 62819320
4,5,6-trichloro-2-methylquinoline
CID 69171121
2,6,7-trichloro-1-ethylindole-3-carbaldehyde
CID 82269486
3-ethyl-5-fluoro-2,6-dimethylquinazolin-4-one
CID 118670739
7-chloro-2-[(1S)-1-chloroethyl]-1-ethylbenzimidazole
CID 93303287
(7-chloro-1-ethylbenzimidazol-2-yl)hydrazine
CID 115059664
3-(7-chloro-1-ethylbenzimidazol-2-yl)-5-methylthiophen-2-amine
CID 63618561
1-ethyl-2-methylbenzimidazole-5-sulfonyl chloride
CID 82500246
3-(chloromethyl)-5-(2,3-dichlorophenyl)-4-ethyl-1,2,4-triazole
CID 115398141

Frequently Asked Questions

What is the IUPAC name of 6,7-dichloro-1-ethyl-2-methylbenzimidazole?
The IUPAC name of 6,7-dichloro-1-ethyl-2-methylbenzimidazole (CID 154116505) is 6,7-dichloro-1-ethyl-2-methylbenzimidazole.
What is the SMILES notation for 6,7-dichloro-1-ethyl-2-methylbenzimidazole?
The canonical SMILES for 6,7-dichloro-1-ethyl-2-methylbenzimidazole is CCn1c(C)nc2ccc(Cl)c(Cl)c21.
What is the InChIKey of 6,7-dichloro-1-ethyl-2-methylbenzimidazole?
The InChIKey is ZLBNRKUMZNRYQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10Cl2N2/c1-3-14-6(2)13-8-5-4-7(11)9(12)10(8)14/h4-5H,3H2,1-2H3.
What are the key properties of 6,7-dichloro-1-ethyl-2-methylbenzimidazole?
6,7-dichloro-1-ethyl-2-methylbenzimidazole has a molecular weight of 229.11 g/mol, XLogP of 3.67, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dichloro-1-ethyl-2-methylbenzimidazole is sourced from PubChem (CID 154116505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).