(4-thiophen-3-yl-1,3-thiazol-5-yl)methanamine

C8H8N2S2 — CID 68582558

IUPAC(4-thiophen-3-yl-1,3-thiazol-5-yl)methanamine
SMILESNCc1scnc1-c1ccsc1
InChIInChI=1S/C8H8N2S2/c9-3-7-8(10-5-12-7)6-1-2-11-4-6/h1-2,4-5H,3,9H2
InChIKeyLZEFEQFSGYPJSG-UHFFFAOYSA-N
MW196.30 g/mol
LogP2.33
Rot. Bonds2

About (4-thiophen-3-yl-1,3-thiazol-5-yl)methanamine

(4-thiophen-3-yl-1,3-thiazol-5-yl)methanamine (PubChem CID 68582558) has the molecular formula C8H8N2S2 and a molecular weight of 196.30 g/mol. Its IUPAC name is (4-thiophen-3-yl-1,3-thiazol-5-yl)methanamine.

Molecular Properties

Compound Name(4-thiophen-3-yl-1,3-thiazol-5-yl)methanamine
PubChem CID68582558
Molecular FormulaC8H8N2S2
Molecular Weight196.30 g/mol
Exact Mass196.01
IUPAC Name(4-thiophen-3-yl-1,3-thiazol-5-yl)methanamine
SMILESNCc1scnc1-c1ccsc1
InChIInChI=1S/C8H8N2S2/c9-3-7-8(10-5-12-7)6-1-2-11-4-6/h1-2,4-5H,3,9H2
InChIKeyLZEFEQFSGYPJSG-UHFFFAOYSA-N
XLogP2.33
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.30
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (4-thiophen-3-yl-1,3-thiazol-5-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

Frequently Asked Questions

What is the IUPAC name of (4-thiophen-3-yl-1,3-thiazol-5-yl)methanamine?
The IUPAC name of (4-thiophen-3-yl-1,3-thiazol-5-yl)methanamine (CID 68582558) is (4-thiophen-3-yl-1,3-thiazol-5-yl)methanamine.
What is the SMILES notation for (4-thiophen-3-yl-1,3-thiazol-5-yl)methanamine?
The canonical SMILES for (4-thiophen-3-yl-1,3-thiazol-5-yl)methanamine is NCc1scnc1-c1ccsc1.
What is the InChIKey of (4-thiophen-3-yl-1,3-thiazol-5-yl)methanamine?
The InChIKey is LZEFEQFSGYPJSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2S2/c9-3-7-8(10-5-12-7)6-1-2-11-4-6/h1-2,4-5H,3,9H2.
What are the key properties of (4-thiophen-3-yl-1,3-thiazol-5-yl)methanamine?
(4-thiophen-3-yl-1,3-thiazol-5-yl)methanamine has a molecular weight of 196.30 g/mol, XLogP of 2.33, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-thiophen-3-yl-1,3-thiazol-5-yl)methanamine is sourced from PubChem (CID 68582558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).