2-[2-(5-bromofuran-2-yl)-1,3-thiazol-4-yl]propan-1-amine

C10H11BrN2OS — CID 115089098

IUPAC2-[2-(5-bromofuran-2-yl)-1,3-thiazol-4-yl]propan-1-amine
SMILESCC(CN)c1csc(-c2ccc(Br)o2)n1
InChIInChI=1S/C10H11BrN2OS/c1-6(4-12)7-5-15-10(13-7)8-2-3-9(11)14-8/h2-3,5-6H,4,12H2,1H3
InChIKeyWMVLJFXBUOXOIC-UHFFFAOYSA-N
MW287.18 g/mol
LogP3.23
Rot. Bonds3

About 2-[2-(5-bromofuran-2-yl)-1,3-thiazol-4-yl]propan-1-amine

2-[2-(5-bromofuran-2-yl)-1,3-thiazol-4-yl]propan-1-amine (PubChem CID 115089098) has the molecular formula C10H11BrN2OS and a molecular weight of 287.18 g/mol. Its IUPAC name is 2-[2-(5-bromofuran-2-yl)-1,3-thiazol-4-yl]propan-1-amine.

Molecular Properties

Compound Name2-[2-(5-bromofuran-2-yl)-1,3-thiazol-4-yl]propan-1-amine
PubChem CID115089098
Molecular FormulaC10H11BrN2OS
Molecular Weight287.18 g/mol
Exact Mass285.98
IUPAC Name2-[2-(5-bromofuran-2-yl)-1,3-thiazol-4-yl]propan-1-amine
SMILESCC(CN)c1csc(-c2ccc(Br)o2)n1
InChIInChI=1S/C10H11BrN2OS/c1-6(4-12)7-5-15-10(13-7)8-2-3-9(11)14-8/h2-3,5-6H,4,12H2,1H3
InChIKeyWMVLJFXBUOXOIC-UHFFFAOYSA-N
XLogP3.23
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.18
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[2-(5-bromofuran-2-yl)-1,3-thiazol-4-yl]propan-1-amine 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-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]propan-1-ol
CID 115089095
2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]butan-1-amine
CID 116891347
ethyl 2-(5-bromofuran-2-yl)-1,3-thiazole-4-carboxylate
CID 115280369
2-[2-(5-bromofuran-2-yl)-1,3-thiazol-4-yl]-N-methylethanamine
CID 115089119
2-(5-bromofuran-2-yl)-1,3-thiazole-4-carbaldehyde
CID 60998358
2-(2-methoxy-1,3-thiazol-4-yl)propan-1-amine
CID 82598532
4-(5-bromofuran-2-yl)-N-(2-methylpropyl)-1,3-thiazol-2-amine
CID 104653304
2-[2-(2-piperidin-1-ylethyl)-1,3-thiazol-4-yl]propan-1-amine
CID 115089632
2-[2-(2-ethoxypropan-2-yl)-1,3-thiazol-4-yl]propan-1-amine
CID 102929390
4-(5-bromofuran-2-yl)-2-(4-bromophenyl)-1,3-thiazole
CID 113437726
4-(5-bromofuran-2-yl)-2-(2-bromophenyl)-1,3-thiazole
CID 104654186
1-[5-(5-bromofuran-2-yl)-1,2,4-oxadiazol-3-yl]propan-2-amine
CID 62651224

Frequently Asked Questions

What is the IUPAC name of 2-[2-(5-bromofuran-2-yl)-1,3-thiazol-4-yl]propan-1-amine?
The IUPAC name of 2-[2-(5-bromofuran-2-yl)-1,3-thiazol-4-yl]propan-1-amine (CID 115089098) is 2-[2-(5-bromofuran-2-yl)-1,3-thiazol-4-yl]propan-1-amine.
What is the SMILES notation for 2-[2-(5-bromofuran-2-yl)-1,3-thiazol-4-yl]propan-1-amine?
The canonical SMILES for 2-[2-(5-bromofuran-2-yl)-1,3-thiazol-4-yl]propan-1-amine is CC(CN)c1csc(-c2ccc(Br)o2)n1.
What is the InChIKey of 2-[2-(5-bromofuran-2-yl)-1,3-thiazol-4-yl]propan-1-amine?
The InChIKey is WMVLJFXBUOXOIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrN2OS/c1-6(4-12)7-5-15-10(13-7)8-2-3-9(11)14-8/h2-3,5-6H,4,12H2,1H3.
What are the key properties of 2-[2-(5-bromofuran-2-yl)-1,3-thiazol-4-yl]propan-1-amine?
2-[2-(5-bromofuran-2-yl)-1,3-thiazol-4-yl]propan-1-amine has a molecular weight of 287.18 g/mol, XLogP of 3.23, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(5-bromofuran-2-yl)-1,3-thiazol-4-yl]propan-1-amine is sourced from PubChem (CID 115089098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).