2-(4-bromo-2-methyl-1H-imidazol-5-yl)ethanamine

C6H10BrN3 — CID 83638263

IUPAC2-(4-bromo-2-methyl-1H-imidazol-5-yl)ethanamine
SMILESCc1nc(Br)c(CCN)[nH]1
InChIInChI=1S/C6H10BrN3/c1-4-9-5(2-3-8)6(7)10-4/h2-3,8H2,1H3,(H,9,10)
InChIKeyLWXSFYYSLFKPMR-UHFFFAOYSA-N
MW204.07 g/mol
LogP0.98
Rot. Bonds2

About 2-(4-bromo-2-methyl-1H-imidazol-5-yl)ethanamine

2-(4-bromo-2-methyl-1H-imidazol-5-yl)ethanamine (PubChem CID 83638263) has the molecular formula C6H10BrN3 and a molecular weight of 204.07 g/mol. Its IUPAC name is 2-(4-bromo-2-methyl-1H-imidazol-5-yl)ethanamine.

Molecular Properties

Compound Name2-(4-bromo-2-methyl-1H-imidazol-5-yl)ethanamine
PubChem CID83638263
Molecular FormulaC6H10BrN3
Molecular Weight204.07 g/mol
Exact Mass203.01
IUPAC Name2-(4-bromo-2-methyl-1H-imidazol-5-yl)ethanamine
SMILESCc1nc(Br)c(CCN)[nH]1
InChIInChI=1S/C6H10BrN3/c1-4-9-5(2-3-8)6(7)10-4/h2-3,8H2,1H3,(H,9,10)
InChIKeyLWXSFYYSLFKPMR-UHFFFAOYSA-N
XLogP0.98
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.07
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(4-bromo-2-methyl-1H-imidazol-5-yl)ethanamine 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

2-[4-(4-fluorophenyl)-2-methyl-1H-imidazol-5-yl]ethanamine
CID 82285806
2-[4-(2,4-dimethylphenyl)-2-methyl-1H-imidazol-5-yl]ethanamine
CID 82288567
[4-(aminomethyl)-2-methyl-1H-imidazol-5-yl]methanamine
CID 55289219
(4-tert-butyl-2-methyl-1H-imidazol-5-yl)methanamine
CID 82373832
[4-(hydroxymethyl)-2-methyl-1H-imidazol-5-yl]methanol
CID 10920614
2-[4-(4-methoxy-3-propan-2-ylphenyl)-2-methyl-1H-imidazol-5-yl]ethanamine
CID 95475739
2-(3-bromo-4,7-dimethyl-1H-indol-2-yl)ethanamine
CID 84640405
2-[4-(2-methoxy-5-propan-2-ylphenyl)-2-methyl-1H-imidazol-5-yl]ethanamine
CID 95475742
5-(bromomethyl)-4-chloro-2-methyl-1H-imidazole
CID 90873915
5-(aminomethyl)-2-methyl-1H-imidazole-4-carboxylic acid
CID 83670470
2-(4-bromo-2-ethyl-1,3-thiazol-5-yl)ethanamine
CID 83824283
2-(1-bromo-6-methyl-3H-imidazo[1,2-a]benzimidazol-2-yl)ethanamine
CID 84643891

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromo-2-methyl-1H-imidazol-5-yl)ethanamine?
The IUPAC name of 2-(4-bromo-2-methyl-1H-imidazol-5-yl)ethanamine (CID 83638263) is 2-(4-bromo-2-methyl-1H-imidazol-5-yl)ethanamine.
What is the SMILES notation for 2-(4-bromo-2-methyl-1H-imidazol-5-yl)ethanamine?
The canonical SMILES for 2-(4-bromo-2-methyl-1H-imidazol-5-yl)ethanamine is Cc1nc(Br)c(CCN)[nH]1.
What is the InChIKey of 2-(4-bromo-2-methyl-1H-imidazol-5-yl)ethanamine?
The InChIKey is LWXSFYYSLFKPMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10BrN3/c1-4-9-5(2-3-8)6(7)10-4/h2-3,8H2,1H3,(H,9,10).
What are the key properties of 2-(4-bromo-2-methyl-1H-imidazol-5-yl)ethanamine?
2-(4-bromo-2-methyl-1H-imidazol-5-yl)ethanamine has a molecular weight of 204.07 g/mol, XLogP of 0.98, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromo-2-methyl-1H-imidazol-5-yl)ethanamine is sourced from PubChem (CID 83638263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).