5-bromo-2-chloro-1-cyclopropylbenzimidazole

C10H8BrClN2 — CID 83680821

IUPAC5-bromo-2-chloro-1-cyclopropylbenzimidazole
SMILESClc1nc2cc(Br)ccc2n1C1CC1
InChIInChI=1S/C10H8BrClN2/c11-6-1-4-9-8(5-6)13-10(12)14(9)7-2-3-7/h1,4-5,7H,2-3H2
InChIKeyYGSCJUTYDVPQRV-UHFFFAOYSA-N
MW271.55 g/mol
LogP3.79
Rot. Bonds1

About 5-bromo-2-chloro-1-cyclopropylbenzimidazole

5-bromo-2-chloro-1-cyclopropylbenzimidazole (PubChem CID 83680821) has the molecular formula C10H8BrClN2 and a molecular weight of 271.55 g/mol. Its IUPAC name is 5-bromo-2-chloro-1-cyclopropylbenzimidazole.

Molecular Properties

Compound Name5-bromo-2-chloro-1-cyclopropylbenzimidazole
PubChem CID83680821
Molecular FormulaC10H8BrClN2
Molecular Weight271.55 g/mol
Exact Mass269.96
IUPAC Name5-bromo-2-chloro-1-cyclopropylbenzimidazole
SMILESClc1nc2cc(Br)ccc2n1C1CC1
InChIInChI=1S/C10H8BrClN2/c11-6-1-4-9-8(5-6)13-10(12)14(9)7-2-3-7/h1,4-5,7H,2-3H2
InChIKeyYGSCJUTYDVPQRV-UHFFFAOYSA-N
XLogP3.79
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.55
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 5-bromo-2-chloro-1-cyclopropylbenzimidazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-bromo-2-(chloromethyl)-1-cyclopropylbenzimidazole
CID 43660199
2-chloro-1-cyclopropylbenzimidazol-5-ol
CID 83834342
2-chloro-1-cyclopropyl-5,6-dimethylbenzimidazole
CID 83838088
2-chloro-1-cyclopropylbenzimidazole-5-carboxylic acid
CID 83842368
2-chloro-1-cyclobutylbenzimidazol-5-ol
CID 84788817
5-bromo-2-[chloro(phenyl)methyl]-1-cyclopropylbenzimidazole
CID 60783340
3-(5-bromo-1-cyclopropylbenzimidazol-2-yl)aniline
CID 60783333
1-amino-1-(5-bromo-1-cyclopropylbenzimidazol-2-yl)propan-2-ol
CID 54920296
5-bromo-2-(chloromethyl)-1-(4-ethylcyclohexyl)benzimidazole
CID 63545228
5-bromo-2-(5-bromo-1-cyclopropylbenzimidazol-2-yl)aniline
CID 63494896
2-amino-2-(5-bromo-1-cyclopropylbenzimidazol-2-yl)ethanol
CID 60783807
[1-(5-bromo-1-cyclopropylbenzimidazol-2-yl)cyclopropyl]methanamine
CID 115450560

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-chloro-1-cyclopropylbenzimidazole?
The IUPAC name of 5-bromo-2-chloro-1-cyclopropylbenzimidazole (CID 83680821) is 5-bromo-2-chloro-1-cyclopropylbenzimidazole.
What is the SMILES notation for 5-bromo-2-chloro-1-cyclopropylbenzimidazole?
The canonical SMILES for 5-bromo-2-chloro-1-cyclopropylbenzimidazole is Clc1nc2cc(Br)ccc2n1C1CC1.
What is the InChIKey of 5-bromo-2-chloro-1-cyclopropylbenzimidazole?
The InChIKey is YGSCJUTYDVPQRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrClN2/c11-6-1-4-9-8(5-6)13-10(12)14(9)7-2-3-7/h1,4-5,7H,2-3H2.
What are the key properties of 5-bromo-2-chloro-1-cyclopropylbenzimidazole?
5-bromo-2-chloro-1-cyclopropylbenzimidazole has a molecular weight of 271.55 g/mol, XLogP of 3.79, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-chloro-1-cyclopropylbenzimidazole is sourced from PubChem (CID 83680821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).