5-(3-imidazol-1-ylphenyl)-1,3-thiazol-2-amine

C12H10N4S — CID 129285315

IUPAC5-(3-imidazol-1-ylphenyl)-1,3-thiazol-2-amine
SMILESNc1ncc(-c2cccc(-n3ccnc3)c2)s1
InChIInChI=1S/C12H10N4S/c13-12-15-7-11(17-12)9-2-1-3-10(6-9)16-5-4-14-8-16/h1-8H,(H2,13,15)
InChIKeyFCLJPQOGCCIBTQ-UHFFFAOYSA-N
MW242.31 g/mol
LogP2.58
Rot. Bonds2

About 5-(3-imidazol-1-ylphenyl)-1,3-thiazol-2-amine

5-(3-imidazol-1-ylphenyl)-1,3-thiazol-2-amine (PubChem CID 129285315) has the molecular formula C12H10N4S and a molecular weight of 242.31 g/mol. Its IUPAC name is 5-(3-imidazol-1-ylphenyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(3-imidazol-1-ylphenyl)-1,3-thiazol-2-amine
PubChem CID129285315
Molecular FormulaC12H10N4S
Molecular Weight242.31 g/mol
Exact Mass242.06
IUPAC Name5-(3-imidazol-1-ylphenyl)-1,3-thiazol-2-amine
SMILESNc1ncc(-c2cccc(-n3ccnc3)c2)s1
InChIInChI=1S/C12H10N4S/c13-12-15-7-11(17-12)9-2-1-3-10(6-9)16-5-4-14-8-16/h1-8H,(H2,13,15)
InChIKeyFCLJPQOGCCIBTQ-UHFFFAOYSA-N
XLogP2.58
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.31
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-(3-imidazol-1-ylphenyl)-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

Frequently Asked Questions

What is the IUPAC name of 5-(3-imidazol-1-ylphenyl)-1,3-thiazol-2-amine?
The IUPAC name of 5-(3-imidazol-1-ylphenyl)-1,3-thiazol-2-amine (CID 129285315) is 5-(3-imidazol-1-ylphenyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(3-imidazol-1-ylphenyl)-1,3-thiazol-2-amine?
The canonical SMILES for 5-(3-imidazol-1-ylphenyl)-1,3-thiazol-2-amine is Nc1ncc(-c2cccc(-n3ccnc3)c2)s1.
What is the InChIKey of 5-(3-imidazol-1-ylphenyl)-1,3-thiazol-2-amine?
The InChIKey is FCLJPQOGCCIBTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N4S/c13-12-15-7-11(17-12)9-2-1-3-10(6-9)16-5-4-14-8-16/h1-8H,(H2,13,15).
What are the key properties of 5-(3-imidazol-1-ylphenyl)-1,3-thiazol-2-amine?
5-(3-imidazol-1-ylphenyl)-1,3-thiazol-2-amine has a molecular weight of 242.31 g/mol, XLogP of 2.58, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-imidazol-1-ylphenyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 129285315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).