[1-(5-bromo-1-cyclopropylbenzimidazol-2-yl)cyclopentyl]methanamine

C16H20BrN3 — CID 115433468

IUPAC[1-(5-bromo-1-cyclopropylbenzimidazol-2-yl)cyclopentyl]methanamine
SMILESNCC1(c2nc3cc(Br)ccc3n2C2CC2)CCCC1
InChIInChI=1S/C16H20BrN3/c17-11-3-6-14-13(9-11)19-15(20(14)12-4-5-12)16(10-18)7-1-2-8-16/h3,6,9,12H,1-2,4-5,7-8,10,18H2
InChIKeyLNQCZANDIHFTNG-UHFFFAOYSA-N
MW334.26 g/mol
LogP3.90
Rot. Bonds3

About [1-(5-bromo-1-cyclopropylbenzimidazol-2-yl)cyclopentyl]methanamine

[1-(5-bromo-1-cyclopropylbenzimidazol-2-yl)cyclopentyl]methanamine (PubChem CID 115433468) has the molecular formula C16H20BrN3 and a molecular weight of 334.26 g/mol. Its IUPAC name is [1-(5-bromo-1-cyclopropylbenzimidazol-2-yl)cyclopentyl]methanamine.

Molecular Properties

Compound Name[1-(5-bromo-1-cyclopropylbenzimidazol-2-yl)cyclopentyl]methanamine
PubChem CID115433468
Molecular FormulaC16H20BrN3
Molecular Weight334.26 g/mol
Exact Mass333.08
IUPAC Name[1-(5-bromo-1-cyclopropylbenzimidazol-2-yl)cyclopentyl]methanamine
SMILESNCC1(c2nc3cc(Br)ccc3n2C2CC2)CCCC1
InChIInChI=1S/C16H20BrN3/c17-11-3-6-14-13(9-11)19-15(20(14)12-4-5-12)16(10-18)7-1-2-8-16/h3,6,9,12H,1-2,4-5,7-8,10,18H2
InChIKeyLNQCZANDIHFTNG-UHFFFAOYSA-N
XLogP3.90
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.26
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-(5-bromo-1-cyclopropylbenzimidazol-2-yl)cyclopentyl]methanamine 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

[1-(5-bromo-1-cyclopropylbenzimidazol-2-yl)cyclopropyl]methanamine
CID 115450560
[1-(1-cyclopropyl-5-methylbenzimidazol-2-yl)cyclopentyl]methanamine
CID 115433455
5-bromo-1-cyclopropyl-2-(2-ethylpyrrolidin-2-yl)benzimidazole
CID 83058754
2-(5-bromo-1-cyclopropylbenzimidazol-2-yl)-2-methylpropan-1-amine
CID 115427812
[4-(5-bromo-1-cyclopropylbenzimidazol-2-yl)phenyl]methanamine
CID 60783970
5-bromo-2-(chloromethyl)-1-cyclopropylbenzimidazole
CID 43660199
5-bromo-2-chloro-1-cyclopropylbenzimidazole
CID 83680821
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-cyclopropyl-2-(3-ethylpiperidin-3-yl)-5-fluorobenzimidazole
CID 63133597
[4-(1-cyclopropyl-6-fluorobenzimidazol-2-yl)oxan-4-yl]methanamine
CID 115438879
3-(5-bromo-1-cyclopropylbenzimidazol-2-yl)aniline
CID 60783333

Frequently Asked Questions

What is the IUPAC name of [1-(5-bromo-1-cyclopropylbenzimidazol-2-yl)cyclopentyl]methanamine?
The IUPAC name of [1-(5-bromo-1-cyclopropylbenzimidazol-2-yl)cyclopentyl]methanamine (CID 115433468) is [1-(5-bromo-1-cyclopropylbenzimidazol-2-yl)cyclopentyl]methanamine.
What is the SMILES notation for [1-(5-bromo-1-cyclopropylbenzimidazol-2-yl)cyclopentyl]methanamine?
The canonical SMILES for [1-(5-bromo-1-cyclopropylbenzimidazol-2-yl)cyclopentyl]methanamine is NCC1(c2nc3cc(Br)ccc3n2C2CC2)CCCC1.
What is the InChIKey of [1-(5-bromo-1-cyclopropylbenzimidazol-2-yl)cyclopentyl]methanamine?
The InChIKey is LNQCZANDIHFTNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20BrN3/c17-11-3-6-14-13(9-11)19-15(20(14)12-4-5-12)16(10-18)7-1-2-8-16/h3,6,9,12H,1-2,4-5,7-8,10,18H2.
What are the key properties of [1-(5-bromo-1-cyclopropylbenzimidazol-2-yl)cyclopentyl]methanamine?
[1-(5-bromo-1-cyclopropylbenzimidazol-2-yl)cyclopentyl]methanamine has a molecular weight of 334.26 g/mol, XLogP of 3.90, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-bromo-1-cyclopropylbenzimidazol-2-yl)cyclopentyl]methanamine is sourced from PubChem (CID 115433468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).