5-(4-bromo-2-chlorophenyl)-N-methyl-1,3-thiazol-2-amine

C10H8BrClN2S — CID 116811845

IUPAC5-(4-bromo-2-chlorophenyl)-N-methyl-1,3-thiazol-2-amine
SMILESCNc1ncc(-c2ccc(Br)cc2Cl)s1
InChIInChI=1S/C10H8BrClN2S/c1-13-10-14-5-9(15-10)7-3-2-6(11)4-8(7)12/h2-5H,1H3,(H,13,14)
InChIKeyALLAJJGFXZMOJP-UHFFFAOYSA-N
MW303.61 g/mol
LogP4.27
Rot. Bonds2

About 5-(4-bromo-2-chlorophenyl)-N-methyl-1,3-thiazol-2-amine

5-(4-bromo-2-chlorophenyl)-N-methyl-1,3-thiazol-2-amine (PubChem CID 116811845) has the molecular formula C10H8BrClN2S and a molecular weight of 303.61 g/mol. Its IUPAC name is 5-(4-bromo-2-chlorophenyl)-N-methyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(4-bromo-2-chlorophenyl)-N-methyl-1,3-thiazol-2-amine
PubChem CID116811845
Molecular FormulaC10H8BrClN2S
Molecular Weight303.61 g/mol
Exact Mass301.93
IUPAC Name5-(4-bromo-2-chlorophenyl)-N-methyl-1,3-thiazol-2-amine
SMILESCNc1ncc(-c2ccc(Br)cc2Cl)s1
InChIInChI=1S/C10H8BrClN2S/c1-13-10-14-5-9(15-10)7-3-2-6(11)4-8(7)12/h2-5H,1H3,(H,13,14)
InChIKeyALLAJJGFXZMOJP-UHFFFAOYSA-N
XLogP4.27
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.61
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-(4-bromo-2-chlorophenyl)-N-methyl-1,3-thiazol-2-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

5-(4-bromo-2-chlorophenyl)-2-methoxy-1,3-thiazole
CID 58258261
6-(4-bromo-2-chlorophenyl)-N-methylpyridazin-3-amine
CID 82779563
5-(2-chloro-6-fluorophenyl)-N-methyl-1,3-thiazol-2-amine
CID 116811869
1-[5-(4-bromo-2-chlorophenyl)thiophen-2-yl]-N-ethylethanamine
CID 43288278
1-[5-(4-bromo-2-chlorophenyl)thiophen-2-yl]-N-ethylpropan-1-amine
CID 43288275
5-(5-bromo-2-fluorophenyl)-N-propyl-1,3-thiazol-2-amine
CID 116812191
5-(2-chlorophenyl)-N-ethyl-1,3-thiazol-2-amine
CID 116811958
N-methyl-5-(2,4,6-trimethylphenyl)-1,3-thiazol-2-amine
CID 116811809
4-(4-bromo-2-chlorophenyl)-N-ethyl-1,3-thiazol-2-amine
CID 82774650
5-(3-fluoro-4-methylphenyl)-N-methyl-1,3-thiazol-2-amine
CID 116811882
N-[[5-(4-bromo-2-chlorophenyl)-1H-imidazol-2-yl]methyl]propan-2-amine
CID 82779512
1-[5-(4-bromo-2-chlorophenyl)-1,2-oxazol-3-yl]-N-methylmethanamine
CID 82781042

Frequently Asked Questions

What is the IUPAC name of 5-(4-bromo-2-chlorophenyl)-N-methyl-1,3-thiazol-2-amine?
The IUPAC name of 5-(4-bromo-2-chlorophenyl)-N-methyl-1,3-thiazol-2-amine (CID 116811845) is 5-(4-bromo-2-chlorophenyl)-N-methyl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(4-bromo-2-chlorophenyl)-N-methyl-1,3-thiazol-2-amine?
The canonical SMILES for 5-(4-bromo-2-chlorophenyl)-N-methyl-1,3-thiazol-2-amine is CNc1ncc(-c2ccc(Br)cc2Cl)s1.
What is the InChIKey of 5-(4-bromo-2-chlorophenyl)-N-methyl-1,3-thiazol-2-amine?
The InChIKey is ALLAJJGFXZMOJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrClN2S/c1-13-10-14-5-9(15-10)7-3-2-6(11)4-8(7)12/h2-5H,1H3,(H,13,14).
What are the key properties of 5-(4-bromo-2-chlorophenyl)-N-methyl-1,3-thiazol-2-amine?
5-(4-bromo-2-chlorophenyl)-N-methyl-1,3-thiazol-2-amine has a molecular weight of 303.61 g/mol, XLogP of 4.27, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-bromo-2-chlorophenyl)-N-methyl-1,3-thiazol-2-amine is sourced from PubChem (CID 116811845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).