[4-(5-bromothiophen-2-yl)-5-methyl-1H-imidazol-2-yl]methanamine

C9H10BrN3S — CID 82488404

IUPAC[4-(5-bromothiophen-2-yl)-5-methyl-1H-imidazol-2-yl]methanamine
SMILESCc1[nH]c(CN)nc1-c1ccc(Br)s1
InChIInChI=1S/C9H10BrN3S/c1-5-9(13-8(4-11)12-5)6-2-3-7(10)14-6/h2-3H,4,11H2,1H3,(H,12,13)
InChIKeyJLJOOLMNMCGROY-UHFFFAOYSA-N
MW272.17 g/mol
LogP2.67
Rot. Bonds2

About [4-(5-bromothiophen-2-yl)-5-methyl-1H-imidazol-2-yl]methanamine

[4-(5-bromothiophen-2-yl)-5-methyl-1H-imidazol-2-yl]methanamine (PubChem CID 82488404) has the molecular formula C9H10BrN3S and a molecular weight of 272.17 g/mol. Its IUPAC name is [4-(5-bromothiophen-2-yl)-5-methyl-1H-imidazol-2-yl]methanamine.

Molecular Properties

Compound Name[4-(5-bromothiophen-2-yl)-5-methyl-1H-imidazol-2-yl]methanamine
PubChem CID82488404
Molecular FormulaC9H10BrN3S
Molecular Weight272.17 g/mol
Exact Mass270.98
IUPAC Name[4-(5-bromothiophen-2-yl)-5-methyl-1H-imidazol-2-yl]methanamine
SMILESCc1[nH]c(CN)nc1-c1ccc(Br)s1
InChIInChI=1S/C9H10BrN3S/c1-5-9(13-8(4-11)12-5)6-2-3-7(10)14-6/h2-3H,4,11H2,1H3,(H,12,13)
InChIKeyJLJOOLMNMCGROY-UHFFFAOYSA-N
XLogP2.67
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.17
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [4-(5-bromothiophen-2-yl)-5-methyl-1H-imidazol-2-yl]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

(5-methyl-4-phenyl-1H-imidazol-2-yl)methanamine
CID 43649240
[4-(4-fluorophenyl)-5-methyl-1H-imidazol-2-yl]methanamine
CID 43649221
4-[2-(aminomethyl)-5-methyl-1H-imidazol-4-yl]-N,N-dimethylaniline
CID 82474486
[4-bromo-3-(5-bromothiophen-2-yl)-1H-pyrazol-5-yl]methanamine
CID 84611015
2-[4-(5-bromothiophen-2-yl)-5-chloro-1H-imidazol-2-yl]-N-methylethanamine
CID 84604354
2-[4-(3-bromophenyl)-5-methyl-1H-imidazol-2-yl]ethanamine
CID 82489288
2-[5-(5-bromothiophen-2-yl)-1-methyl-1,2,4-triazol-3-yl]ethanamine
CID 82489655
3-[4-(4-bromophenyl)-5-methyl-1H-imidazol-2-yl]propan-1-amine
CID 43650829
2-(5-bromothiophen-2-yl)-5,6-dimethyl-1H-pyrimidine-4-thione
CID 106476810
4-[2-(2-aminoethyl)-5-methyl-1H-imidazol-4-yl]phenol
CID 105471255
[2-(5-bromothiophen-2-yl)-5-ethyl-6-methylpyrimidin-4-yl]hydrazine
CID 62252598
2-[4-(5-bromothiophen-2-yl)-5-chloro-1-methylimidazol-2-yl]ethanamine
CID 84604360

Frequently Asked Questions

What is the IUPAC name of [4-(5-bromothiophen-2-yl)-5-methyl-1H-imidazol-2-yl]methanamine?
The IUPAC name of [4-(5-bromothiophen-2-yl)-5-methyl-1H-imidazol-2-yl]methanamine (CID 82488404) is [4-(5-bromothiophen-2-yl)-5-methyl-1H-imidazol-2-yl]methanamine.
What is the SMILES notation for [4-(5-bromothiophen-2-yl)-5-methyl-1H-imidazol-2-yl]methanamine?
The canonical SMILES for [4-(5-bromothiophen-2-yl)-5-methyl-1H-imidazol-2-yl]methanamine is Cc1[nH]c(CN)nc1-c1ccc(Br)s1.
What is the InChIKey of [4-(5-bromothiophen-2-yl)-5-methyl-1H-imidazol-2-yl]methanamine?
The InChIKey is JLJOOLMNMCGROY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10BrN3S/c1-5-9(13-8(4-11)12-5)6-2-3-7(10)14-6/h2-3H,4,11H2,1H3,(H,12,13).
What are the key properties of [4-(5-bromothiophen-2-yl)-5-methyl-1H-imidazol-2-yl]methanamine?
[4-(5-bromothiophen-2-yl)-5-methyl-1H-imidazol-2-yl]methanamine has a molecular weight of 272.17 g/mol, XLogP of 2.67, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(5-bromothiophen-2-yl)-5-methyl-1H-imidazol-2-yl]methanamine is sourced from PubChem (CID 82488404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).