5-bromo-1-cyclopropylbenzimidazole

C10H9BrN2 — CID 82496945

IUPAC5-bromo-1-cyclopropylbenzimidazole
SMILESBrc1ccc2c(c1)ncn2C1CC1
InChIInChI=1S/C10H9BrN2/c11-7-1-4-10-9(5-7)12-6-13(10)8-2-3-8/h1,4-6,8H,2-3H2
InChIKeyHNEGNHWSDNVYIO-UHFFFAOYSA-N
MW237.10 g/mol
LogP3.13
Rot. Bonds1

About 5-bromo-1-cyclopropylbenzimidazole

5-bromo-1-cyclopropylbenzimidazole (PubChem CID 82496945) has the molecular formula C10H9BrN2 and a molecular weight of 237.10 g/mol. Its IUPAC name is 5-bromo-1-cyclopropylbenzimidazole.

Molecular Properties

Compound Name5-bromo-1-cyclopropylbenzimidazole
PubChem CID82496945
Molecular FormulaC10H9BrN2
Molecular Weight237.10 g/mol
Exact Mass235.99
IUPAC Name5-bromo-1-cyclopropylbenzimidazole
SMILESBrc1ccc2c(c1)ncn2C1CC1
InChIInChI=1S/C10H9BrN2/c11-7-1-4-10-9(5-7)12-6-13(10)8-2-3-8/h1,4-6,8H,2-3H2
InChIKeyHNEGNHWSDNVYIO-UHFFFAOYSA-N
XLogP3.13
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.10
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 5-bromo-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-1-(4,4-difluorocyclohexyl)benzimidazole
CID 118338608
5-bromo-1-(oxetan-3-yl)benzimidazole
CID 83488440
5-bromo-1-(oxan-3-yl)benzimidazole
CID 118338387
N-[4-(5-bromobenzimidazol-1-yl)cyclohexyl]-2,2-dimethylpropanamide
CID 71468624
4-(6-bromobenzimidazol-1-yl)thiane 1-oxide
CID 139394841
5-bromo-1-(2-cyclohexylethyl)benzimidazole
CID 139211305
1-(4-methylcyclohexyl)benzimidazol-5-amine
CID 62507500
cyclopropyl-(1-cyclopropylbenzimidazol-5-yl)methanone
CID 82494686
5-chloro-1-cyclohexylbenzimidazole
CID 15429072
3-(1-cyclopropylbenzimidazol-5-yl)propan-1-amine
CID 82492930
2-(1-cyclopropylbenzimidazol-5-yl)-N-methylpropan-2-amine
CID 82495022
2-(1-cyclopropylbenzimidazol-5-yl)acetic acid
CID 82492988

Frequently Asked Questions

What is the IUPAC name of 5-bromo-1-cyclopropylbenzimidazole?
The IUPAC name of 5-bromo-1-cyclopropylbenzimidazole (CID 82496945) is 5-bromo-1-cyclopropylbenzimidazole.
What is the SMILES notation for 5-bromo-1-cyclopropylbenzimidazole?
The canonical SMILES for 5-bromo-1-cyclopropylbenzimidazole is Brc1ccc2c(c1)ncn2C1CC1.
What is the InChIKey of 5-bromo-1-cyclopropylbenzimidazole?
The InChIKey is HNEGNHWSDNVYIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrN2/c11-7-1-4-10-9(5-7)12-6-13(10)8-2-3-8/h1,4-6,8H,2-3H2.
What are the key properties of 5-bromo-1-cyclopropylbenzimidazole?
5-bromo-1-cyclopropylbenzimidazole has a molecular weight of 237.10 g/mol, XLogP of 3.13, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-1-cyclopropylbenzimidazole is sourced from PubChem (CID 82496945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).