3-(1-fluoroethyl)-1,2,4-thiadiazol-5-amine

C4H6FN3S — CID 174597237

IUPAC3-(1-fluoroethyl)-1,2,4-thiadiazol-5-amine
SMILESCC(F)c1nsc(N)n1
InChIInChI=1S/C4H6FN3S/c1-2(5)3-7-4(6)9-8-3/h2H,1H3,(H2,6,7,8)
InChIKeyMRQUXTQSPPKNPT-UHFFFAOYSA-N
MW147.18 g/mol
LogP1.15
Rot. Bonds1

About 3-(1-fluoroethyl)-1,2,4-thiadiazol-5-amine

3-(1-fluoroethyl)-1,2,4-thiadiazol-5-amine (PubChem CID 174597237) has the molecular formula C4H6FN3S and a molecular weight of 147.18 g/mol. Its IUPAC name is 3-(1-fluoroethyl)-1,2,4-thiadiazol-5-amine.

Molecular Properties

Compound Name3-(1-fluoroethyl)-1,2,4-thiadiazol-5-amine
PubChem CID174597237
Molecular FormulaC4H6FN3S
Molecular Weight147.18 g/mol
Exact Mass147.03
IUPAC Name3-(1-fluoroethyl)-1,2,4-thiadiazol-5-amine
SMILESCC(F)c1nsc(N)n1
InChIInChI=1S/C4H6FN3S/c1-2(5)3-7-4(6)9-8-3/h2H,1H3,(H2,6,7,8)
InChIKeyMRQUXTQSPPKNPT-UHFFFAOYSA-N
XLogP1.15
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.18
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(1-fluoroethyl)-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-(Propan-2-yl)-1,2,4-thiadiazol-5-amine
CID 581957
3-Propyl-1,2,4-thiadiazol-5-amine
CID 575489
5-Amino-3-methyl-1,2,4-thiadiazole
CID 350639
5-Ethyl-1,2,4-thiadiazol-3-amine
CID 12246463
5-Amino-3-ethyl-1,2,4-thiadiazole
CID 2756430
5-Chloro-3-ethyl-1,2,4-thiadiazole
CID 14763517
3-Cyclopropyl-1,2,4-thiadiazol-5-amine
CID 23092533
3-(Difluoromethyl)-1,2,4-thiadiazol-5-amine
CID 105429510
3-Tert-butyl-1,2,4-thiadiazol-5-amine
CID 21688990
3-ethyl-N-methyl-1,2,4-thiadiazol-5-amine
CID 55287031
3-(3,3,3-Trifluoro-propyl)-[1,2,4]thiadiazol-5-ylamine
CID 66898934
5-Ethyl-3-(trifluoromethyl)-1,2,4-thiadiazole
CID 68235669

Frequently Asked Questions

What is the IUPAC name of 3-(1-fluoroethyl)-1,2,4-thiadiazol-5-amine?
The IUPAC name of 3-(1-fluoroethyl)-1,2,4-thiadiazol-5-amine (CID 174597237) is 3-(1-fluoroethyl)-1,2,4-thiadiazol-5-amine.
What is the SMILES notation for 3-(1-fluoroethyl)-1,2,4-thiadiazol-5-amine?
The canonical SMILES for 3-(1-fluoroethyl)-1,2,4-thiadiazol-5-amine is CC(F)c1nsc(N)n1.
What is the InChIKey of 3-(1-fluoroethyl)-1,2,4-thiadiazol-5-amine?
The InChIKey is MRQUXTQSPPKNPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6FN3S/c1-2(5)3-7-4(6)9-8-3/h2H,1H3,(H2,6,7,8).
What are the key properties of 3-(1-fluoroethyl)-1,2,4-thiadiazol-5-amine?
3-(1-fluoroethyl)-1,2,4-thiadiazol-5-amine has a molecular weight of 147.18 g/mol, XLogP of 1.15, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-fluoroethyl)-1,2,4-thiadiazol-5-amine is sourced from PubChem (CID 174597237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).