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

C4H4F2N2S — CID 84763177

IUPAC2-(difluoromethyl)-1,3-thiazol-5-amine
SMILESNc1cnc(C(F)F)s1
InChIInChI=1S/C4H4F2N2S/c5-3(6)4-8-1-2(7)9-4/h1,3H,7H2
InChIKeyXNOOPAHXBYPWGE-UHFFFAOYSA-N
MW150.15 g/mol
LogP1.66
Rot. Bonds1

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

2-(difluoromethyl)-1,3-thiazol-5-amine (PubChem CID 84763177) has the molecular formula C4H4F2N2S and a molecular weight of 150.15 g/mol. Its IUPAC name is 2-(difluoromethyl)-1,3-thiazol-5-amine.

Molecular Properties

Compound Name2-(difluoromethyl)-1,3-thiazol-5-amine
PubChem CID84763177
Molecular FormulaC4H4F2N2S
Molecular Weight150.15 g/mol
Exact Mass150.01
IUPAC Name2-(difluoromethyl)-1,3-thiazol-5-amine
SMILESNc1cnc(C(F)F)s1
InChIInChI=1S/C4H4F2N2S/c5-3(6)4-8-1-2(7)9-4/h1,3H,7H2
InChIKeyXNOOPAHXBYPWGE-UHFFFAOYSA-N
XLogP1.66
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.15
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(difluoromethyl)-1,3-thiazol-5-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 2-(difluoromethyl)-1,3-thiazol-5-amine?
The IUPAC name of 2-(difluoromethyl)-1,3-thiazol-5-amine (CID 84763177) is 2-(difluoromethyl)-1,3-thiazol-5-amine.
What is the SMILES notation for 2-(difluoromethyl)-1,3-thiazol-5-amine?
The canonical SMILES for 2-(difluoromethyl)-1,3-thiazol-5-amine is Nc1cnc(C(F)F)s1.
What is the InChIKey of 2-(difluoromethyl)-1,3-thiazol-5-amine?
The InChIKey is XNOOPAHXBYPWGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4F2N2S/c5-3(6)4-8-1-2(7)9-4/h1,3H,7H2.
What are the key properties of 2-(difluoromethyl)-1,3-thiazol-5-amine?
2-(difluoromethyl)-1,3-thiazol-5-amine has a molecular weight of 150.15 g/mol, XLogP of 1.66, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-1,3-thiazol-5-amine is sourced from PubChem (CID 84763177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).