5-bromo-2-ethyl-1-methylbenzimidazole

C10H11BrN2 — CID 84701099

IUPAC5-bromo-2-ethyl-1-methylbenzimidazole
SMILESCCc1nc2cc(Br)ccc2n1C
InChIInChI=1S/C10H11BrN2/c1-3-10-12-8-6-7(11)4-5-9(8)13(10)2/h4-6H,3H2,1-2H3
InChIKeyFXBCRRHZVLZTDK-UHFFFAOYSA-N
MW239.12 g/mol
LogP2.90
Rot. Bonds1

About 5-bromo-2-ethyl-1-methylbenzimidazole

5-bromo-2-ethyl-1-methylbenzimidazole (PubChem CID 84701099) has the molecular formula C10H11BrN2 and a molecular weight of 239.12 g/mol. Its IUPAC name is 5-bromo-2-ethyl-1-methylbenzimidazole.

Molecular Properties

Compound Name5-bromo-2-ethyl-1-methylbenzimidazole
PubChem CID84701099
Molecular FormulaC10H11BrN2
Molecular Weight239.12 g/mol
Exact Mass238.01
IUPAC Name5-bromo-2-ethyl-1-methylbenzimidazole
SMILESCCc1nc2cc(Br)ccc2n1C
InChIInChI=1S/C10H11BrN2/c1-3-10-12-8-6-7(11)4-5-9(8)13(10)2/h4-6H,3H2,1-2H3
InChIKeyFXBCRRHZVLZTDK-UHFFFAOYSA-N
XLogP2.90
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.12
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(5-bromo-2-ethylbenzimidazol-1-yl)-iodophosphane
CID 177354823
2-(5-bromo-2-ethylbenzimidazol-1-yl)ethanamine
CID 84808266
N-[(5-bromo-1-methylbenzimidazol-2-yl)methyl]cyclopropanamine
CID 60836537
4-(5-bromo-1-methylbenzimidazol-2-yl)-2-methylbutan-1-amine
CID 82683696
3-(5-bromo-1-methylbenzimidazol-2-yl)-1,1,1-trifluoropropan-2-one
CID 79873273
3-(5-bromo-2-ethylbenzimidazol-1-yl)propanoic acid
CID 84815767
5-bromo-1-methyl-2-methylsulfanylbenzimidazole
CID 83679153
2-ethyl-5-isocyanato-1-methylbenzimidazole
CID 169353178
2-ethyl-1,6,7-trimethylimidazo[4,5-f]benzimidazole
CID 23572275
3-(aminomethyl)-6-bromo-1-methylquinoxalin-2-one
CID 117274808
5-bromo-1,2-bis(2,2-dimethylpropyl)benzimidazole
CID 90864285
2-(5-bromo-1-ethylbenzimidazol-2-yl)acetonitrile
CID 82332810

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-ethyl-1-methylbenzimidazole?
The IUPAC name of 5-bromo-2-ethyl-1-methylbenzimidazole (CID 84701099) is 5-bromo-2-ethyl-1-methylbenzimidazole.
What is the SMILES notation for 5-bromo-2-ethyl-1-methylbenzimidazole?
The canonical SMILES for 5-bromo-2-ethyl-1-methylbenzimidazole is CCc1nc2cc(Br)ccc2n1C.
What is the InChIKey of 5-bromo-2-ethyl-1-methylbenzimidazole?
The InChIKey is FXBCRRHZVLZTDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrN2/c1-3-10-12-8-6-7(11)4-5-9(8)13(10)2/h4-6H,3H2,1-2H3.
What are the key properties of 5-bromo-2-ethyl-1-methylbenzimidazole?
5-bromo-2-ethyl-1-methylbenzimidazole has a molecular weight of 239.12 g/mol, XLogP of 2.90, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-ethyl-1-methylbenzimidazole is sourced from PubChem (CID 84701099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).