2-(5-bromo-2-ethylbenzimidazol-1-yl)ethanamine

C11H14BrN3 — CID 84808266

IUPAC2-(5-bromo-2-ethylbenzimidazol-1-yl)ethanamine
SMILESCCc1nc2cc(Br)ccc2n1CCN
InChIInChI=1S/C11H14BrN3/c1-2-11-14-9-7-8(12)3-4-10(9)15(11)6-5-13/h3-4,7H,2,5-6,13H2,1H3
InChIKeyFPAZXMSBWVBQCE-UHFFFAOYSA-N
MW268.16 g/mol
LogP2.32
Rot. Bonds3

About 2-(5-bromo-2-ethylbenzimidazol-1-yl)ethanamine

2-(5-bromo-2-ethylbenzimidazol-1-yl)ethanamine (PubChem CID 84808266) has the molecular formula C11H14BrN3 and a molecular weight of 268.16 g/mol. Its IUPAC name is 2-(5-bromo-2-ethylbenzimidazol-1-yl)ethanamine.

Molecular Properties

Compound Name2-(5-bromo-2-ethylbenzimidazol-1-yl)ethanamine
PubChem CID84808266
Molecular FormulaC11H14BrN3
Molecular Weight268.16 g/mol
Exact Mass267.04
IUPAC Name2-(5-bromo-2-ethylbenzimidazol-1-yl)ethanamine
SMILESCCc1nc2cc(Br)ccc2n1CCN
InChIInChI=1S/C11H14BrN3/c1-2-11-14-9-7-8(12)3-4-10(9)15(11)6-5-13/h3-4,7H,2,5-6,13H2,1H3
InChIKeyFPAZXMSBWVBQCE-UHFFFAOYSA-N
XLogP2.32
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.16
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(5-bromo-2-ethylbenzimidazol-1-yl)propanoic acid
CID 84815767
5-bromo-2-ethyl-1-methylbenzimidazole
CID 84701099
5-chloro-2-ethyl-1-propylbenzimidazole
CID 46310723
2-(5-bromo-2-cyclobutylbenzimidazol-1-yl)ethanamine
CID 84815301
(5-bromo-2-ethylbenzimidazol-1-yl)-iodophosphane
CID 177354823
2-[5-bromo-2-(chloromethyl)benzimidazol-1-yl]-N,N-diethylethanamine
CID 43660318
5-bromo-1,2-bis(2,2-dimethylpropyl)benzimidazole
CID 90864285
3-(5-bromo-1-propylbenzimidazol-2-yl)butan-1-amine
CID 80539744
2-[(5-bromo-1-propylbenzimidazol-2-yl)methyl]phenol
CID 80723483
5-bromo-1-butyl-2-(2-methoxyethyl)benzimidazole
CID 22730799
[5-bromo-1-[2-(dimethylamino)ethyl]benzimidazol-2-yl]methanol
CID 82332822
5-bromo-2-(chloromethyl)-1-(3-ethoxypropyl)benzimidazole
CID 43660258

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromo-2-ethylbenzimidazol-1-yl)ethanamine?
The IUPAC name of 2-(5-bromo-2-ethylbenzimidazol-1-yl)ethanamine (CID 84808266) is 2-(5-bromo-2-ethylbenzimidazol-1-yl)ethanamine.
What is the SMILES notation for 2-(5-bromo-2-ethylbenzimidazol-1-yl)ethanamine?
The canonical SMILES for 2-(5-bromo-2-ethylbenzimidazol-1-yl)ethanamine is CCc1nc2cc(Br)ccc2n1CCN.
What is the InChIKey of 2-(5-bromo-2-ethylbenzimidazol-1-yl)ethanamine?
The InChIKey is FPAZXMSBWVBQCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14BrN3/c1-2-11-14-9-7-8(12)3-4-10(9)15(11)6-5-13/h3-4,7H,2,5-6,13H2,1H3.
What are the key properties of 2-(5-bromo-2-ethylbenzimidazol-1-yl)ethanamine?
2-(5-bromo-2-ethylbenzimidazol-1-yl)ethanamine has a molecular weight of 268.16 g/mol, XLogP of 2.32, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromo-2-ethylbenzimidazol-1-yl)ethanamine is sourced from PubChem (CID 84808266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).