N-(2,2-difluoroethyl)-N,3-dimethyl-1,2,4-thiadiazol-5-amine

C6H9F2N3S — CID 126787153

IUPACN-(2,2-difluoroethyl)-N,3-dimethyl-1,2,4-thiadiazol-5-amine
SMILESCc1nsc(N(C)CC(F)F)n1
InChIInChI=1S/C6H9F2N3S/c1-4-9-6(12-10-4)11(2)3-5(7)8/h5H,3H2,1-2H3
InChIKeyWZDMMOXWBJYZGF-UHFFFAOYSA-N
MW193.22 g/mol
LogP1.55
Rot. Bonds3

About N-(2,2-difluoroethyl)-N,3-dimethyl-1,2,4-thiadiazol-5-amine

N-(2,2-difluoroethyl)-N,3-dimethyl-1,2,4-thiadiazol-5-amine (PubChem CID 126787153) has the molecular formula C6H9F2N3S and a molecular weight of 193.22 g/mol. Its IUPAC name is N-(2,2-difluoroethyl)-N,3-dimethyl-1,2,4-thiadiazol-5-amine.

Molecular Properties

Compound NameN-(2,2-difluoroethyl)-N,3-dimethyl-1,2,4-thiadiazol-5-amine
PubChem CID126787153
Molecular FormulaC6H9F2N3S
Molecular Weight193.22 g/mol
Exact Mass193.05
IUPAC NameN-(2,2-difluoroethyl)-N,3-dimethyl-1,2,4-thiadiazol-5-amine
SMILESCc1nsc(N(C)CC(F)F)n1
InChIInChI=1S/C6H9F2N3S/c1-4-9-6(12-10-4)11(2)3-5(7)8/h5H,3H2,1-2H3
InChIKeyWZDMMOXWBJYZGF-UHFFFAOYSA-N
XLogP1.55
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.22
LogP ≤ 51.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-(2,2-difluoroethyl)-N,3-dimethyl-1,2,4-thiadiazol-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

Related Compounds

3-((dimethylamino)methyl)-N,N-dimethyl-1,2,4-thiadiazol-5-amine
CID 332609
5-[3-(2,2-Difluoroethyl)azetidin-1-yl]-3-methyl-1,2,4-thiadiazole
CID 126794128
N-ethyl-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine
CID 107304649
Ethane;5-methyl-3-(trifluoromethyl)-1,2,4-thiadiazole
CID 144394777
3-(3,3-Difluoroazetidin-1-yl)-5-methyl-1,2,4-thiadiazole
CID 169883076
3-methyl-N-(3,3,3-trifluoropropyl)-1,2,4-thiadiazol-5-amine
CID 65268223
3-methyl-N-(2,2,2-trifluoroethyl)-1,2,4-thiadiazol-5-amine
CID 65268372
3-ethyl-N-(2,2,2-trifluoroethyl)-1,2,4-thiadiazol-5-amine
CID 65271080
N-(2,2-difluoroethyl)-3-methyl-1,2,4-thiadiazol-5-amine
CID 79099578
N-ethyl-N-[[5-(trifluoromethyl)-1,2,4-thiadiazol-3-yl]methyl]ethanamine
CID 83959823
N,N-dimethyl-1-[5-(trifluoromethyl)-1,2,4-thiadiazol-3-yl]methanamine
CID 83959824
N'-methyl-N'-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]propane-1,3-diamine
CID 107304454

Frequently Asked Questions

What is the IUPAC name of N-(2,2-difluoroethyl)-N,3-dimethyl-1,2,4-thiadiazol-5-amine?
The IUPAC name of N-(2,2-difluoroethyl)-N,3-dimethyl-1,2,4-thiadiazol-5-amine (CID 126787153) is N-(2,2-difluoroethyl)-N,3-dimethyl-1,2,4-thiadiazol-5-amine.
What is the SMILES notation for N-(2,2-difluoroethyl)-N,3-dimethyl-1,2,4-thiadiazol-5-amine?
The canonical SMILES for N-(2,2-difluoroethyl)-N,3-dimethyl-1,2,4-thiadiazol-5-amine is Cc1nsc(N(C)CC(F)F)n1.
What is the InChIKey of N-(2,2-difluoroethyl)-N,3-dimethyl-1,2,4-thiadiazol-5-amine?
The InChIKey is WZDMMOXWBJYZGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9F2N3S/c1-4-9-6(12-10-4)11(2)3-5(7)8/h5H,3H2,1-2H3.
What are the key properties of N-(2,2-difluoroethyl)-N,3-dimethyl-1,2,4-thiadiazol-5-amine?
N-(2,2-difluoroethyl)-N,3-dimethyl-1,2,4-thiadiazol-5-amine has a molecular weight of 193.22 g/mol, XLogP of 1.55, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-difluoroethyl)-N,3-dimethyl-1,2,4-thiadiazol-5-amine is sourced from PubChem (CID 126787153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).