5-(difluoromethylsulfanyl)-1,3-thiazol-2-amine

C4H4F2N2S2 — CID 43250216

IUPAC5-(difluoromethylsulfanyl)-1,3-thiazol-2-amine
SMILESNc1ncc(SC(F)F)s1
InChIInChI=1S/C4H4F2N2S2/c5-3(6)9-2-1-8-4(7)10-2/h1,3H,(H2,7,8)
InChIKeyDLBYBEJUZCEOKF-UHFFFAOYSA-N
MW182.22 g/mol
LogP2.04
Rot. Bonds2

About 5-(difluoromethylsulfanyl)-1,3-thiazol-2-amine

5-(difluoromethylsulfanyl)-1,3-thiazol-2-amine (PubChem CID 43250216) has the molecular formula C4H4F2N2S2 and a molecular weight of 182.22 g/mol. Its IUPAC name is 5-(difluoromethylsulfanyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(difluoromethylsulfanyl)-1,3-thiazol-2-amine
PubChem CID43250216
Molecular FormulaC4H4F2N2S2
Molecular Weight182.22 g/mol
Exact Mass181.98
IUPAC Name5-(difluoromethylsulfanyl)-1,3-thiazol-2-amine
SMILESNc1ncc(SC(F)F)s1
InChIInChI=1S/C4H4F2N2S2/c5-3(6)9-2-1-8-4(7)10-2/h1,3H,(H2,7,8)
InChIKeyDLBYBEJUZCEOKF-UHFFFAOYSA-N
XLogP2.04
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-(difluoromethylsulfanyl)-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-(difluoromethylsulfanyl)-1,3-thiazol-2-amine?
The IUPAC name of 5-(difluoromethylsulfanyl)-1,3-thiazol-2-amine (CID 43250216) is 5-(difluoromethylsulfanyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(difluoromethylsulfanyl)-1,3-thiazol-2-amine?
The canonical SMILES for 5-(difluoromethylsulfanyl)-1,3-thiazol-2-amine is Nc1ncc(SC(F)F)s1.
What is the InChIKey of 5-(difluoromethylsulfanyl)-1,3-thiazol-2-amine?
The InChIKey is DLBYBEJUZCEOKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4F2N2S2/c5-3(6)9-2-1-8-4(7)10-2/h1,3H,(H2,7,8).
What are the key properties of 5-(difluoromethylsulfanyl)-1,3-thiazol-2-amine?
5-(difluoromethylsulfanyl)-1,3-thiazol-2-amine has a molecular weight of 182.22 g/mol, XLogP of 2.04, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(difluoromethylsulfanyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 43250216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).