5-amino-N-(2,2,2-trifluoroethyl)thiadiazole-4-carboxamide;hydrochloride

C5H6ClF3N4OS — CID 130762952

IUPAC5-amino-N-(2,2,2-trifluoroethyl)thiadiazole-4-carboxamide;hydrochloride
SMILESCl.Nc1snnc1C(=O)NCC(F)(F)F
InChIInChI=1S/C5H5F3N4OS.ClH/c6-5(7,8)1-10-4(13)2-3(9)14-12-11-2;/h1,9H2,(H,10,13);1H
InChIKeyOHTRZJVLDIBAHW-UHFFFAOYSA-N
MW262.64 g/mol
LogP0.83
Rot. Bonds2

About 5-amino-N-(2,2,2-trifluoroethyl)thiadiazole-4-carboxamide;hydrochloride

5-amino-N-(2,2,2-trifluoroethyl)thiadiazole-4-carboxamide;hydrochloride (PubChem CID 130762952) has the molecular formula C5H6ClF3N4OS and a molecular weight of 262.64 g/mol. Its IUPAC name is 5-amino-N-(2,2,2-trifluoroethyl)thiadiazole-4-carboxamide;hydrochloride.

Molecular Properties

Compound Name5-amino-N-(2,2,2-trifluoroethyl)thiadiazole-4-carboxamide;hydrochloride
PubChem CID130762952
Molecular FormulaC5H6ClF3N4OS
Molecular Weight262.64 g/mol
Exact Mass261.99
IUPAC Name5-amino-N-(2,2,2-trifluoroethyl)thiadiazole-4-carboxamide;hydrochloride
SMILESCl.Nc1snnc1C(=O)NCC(F)(F)F
InChIInChI=1S/C5H5F3N4OS.ClH/c6-5(7,8)1-10-4(13)2-3(9)14-12-11-2;/h1,9H2,(H,10,13);1H
InChIKeyOHTRZJVLDIBAHW-UHFFFAOYSA-N
XLogP0.83
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.64
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-amino-N-(2,2,2-trifluoroethyl)thiadiazole-4-carboxamide;hydrochloride 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-amino-N-(2,2,2-trifluoroethyl)thiadiazole-4-carboxamide;hydrochloride?
The IUPAC name of 5-amino-N-(2,2,2-trifluoroethyl)thiadiazole-4-carboxamide;hydrochloride (CID 130762952) is 5-amino-N-(2,2,2-trifluoroethyl)thiadiazole-4-carboxamide;hydrochloride.
What is the SMILES notation for 5-amino-N-(2,2,2-trifluoroethyl)thiadiazole-4-carboxamide;hydrochloride?
The canonical SMILES for 5-amino-N-(2,2,2-trifluoroethyl)thiadiazole-4-carboxamide;hydrochloride is Cl.Nc1snnc1C(=O)NCC(F)(F)F.
What is the InChIKey of 5-amino-N-(2,2,2-trifluoroethyl)thiadiazole-4-carboxamide;hydrochloride?
The InChIKey is OHTRZJVLDIBAHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5F3N4OS.ClH/c6-5(7,8)1-10-4(13)2-3(9)14-12-11-2;/h1,9H2,(H,10,13);1H.
What are the key properties of 5-amino-N-(2,2,2-trifluoroethyl)thiadiazole-4-carboxamide;hydrochloride?
5-amino-N-(2,2,2-trifluoroethyl)thiadiazole-4-carboxamide;hydrochloride has a molecular weight of 262.64 g/mol, XLogP of 0.83, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(2,2,2-trifluoroethyl)thiadiazole-4-carboxamide;hydrochloride is sourced from PubChem (CID 130762952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).