N-(4-fluorophenyl)thiatriazol-5-amine

C7H5FN4S — CID 718655

IUPACN-(4-fluorophenyl)thiatriazol-5-amine
SMILESFc1ccc(Nc2nnns2)cc1
InChIInChI=1S/C7H5FN4S/c8-5-1-3-6(4-2-5)9-7-10-11-12-13-7/h1-4H,(H,9,10,12)
InChIKeySVJUYKBOHMOAJO-UHFFFAOYSA-N
MW196.21 g/mol
LogP1.82
Rot. Bonds2

About N-(4-fluorophenyl)thiatriazol-5-amine

N-(4-fluorophenyl)thiatriazol-5-amine (PubChem CID 718655) has the molecular formula C7H5FN4S and a molecular weight of 196.21 g/mol. Its IUPAC name is N-(4-fluorophenyl)thiatriazol-5-amine.

Molecular Properties

Compound NameN-(4-fluorophenyl)thiatriazol-5-amine
PubChem CID718655
Molecular FormulaC7H5FN4S
Molecular Weight196.21 g/mol
Exact Mass196.02
IUPAC NameN-(4-fluorophenyl)thiatriazol-5-amine
SMILESFc1ccc(Nc2nnns2)cc1
InChIInChI=1S/C7H5FN4S/c8-5-1-3-6(4-2-5)9-7-10-11-12-13-7/h1-4H,(H,9,10,12)
InChIKeySVJUYKBOHMOAJO-UHFFFAOYSA-N
XLogP1.82
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.21
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(4-fluorophenyl)thiatriazol-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

N-phenyl-1H-1,2,3,4-tetrazol-5-amine
CID 141040
N-phenyl-1,3,4-thiadiazol-2-amine
CID 767363
1-Phenyl-3-(1,3,4-thiadiazol-2-yl)thiourea
CID 870537
5-Anilino-1,2,3,4-thiatriazole
CID 83115
N-phenyl-5-(propan-2-ylthio)-1,3,4-thiadiazol-2-amine
CID 2114383
2-[(5-Anilino-1,3,4-thiadiazol-2-yl)sulfanyl]acetonitrile
CID 2488470
N-phenyl-5-phenyldiazenyl-1,3,4-thiadiazol-2-amine
CID 135971353
N-(4-fluorophenyl)-5-(trifluoromethyl)-1,3,4-thiadiazol-2-amine
CID 2730012
N2-(2-fluorophenyl)-5-methyl-1,3,4-thiadiazol-2-amine
CID 2730024
N-(4-methylphenyl)-1,2,3,4-thiatriazol-5-amine
CID 738490
1,2,3,4-Thiatriazol-5-amine, N-(4-chlorophenyl)-
CID 936108
N-(3-fluorophenyl)-5-methyl-1,3,4-thiadiazol-2-amine
CID 2730020

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)thiatriazol-5-amine?
The IUPAC name of N-(4-fluorophenyl)thiatriazol-5-amine (CID 718655) is N-(4-fluorophenyl)thiatriazol-5-amine.
What is the SMILES notation for N-(4-fluorophenyl)thiatriazol-5-amine?
The canonical SMILES for N-(4-fluorophenyl)thiatriazol-5-amine is Fc1ccc(Nc2nnns2)cc1.
What is the InChIKey of N-(4-fluorophenyl)thiatriazol-5-amine?
The InChIKey is SVJUYKBOHMOAJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5FN4S/c8-5-1-3-6(4-2-5)9-7-10-11-12-13-7/h1-4H,(H,9,10,12).
What are the key properties of N-(4-fluorophenyl)thiatriazol-5-amine?
N-(4-fluorophenyl)thiatriazol-5-amine has a molecular weight of 196.21 g/mol, XLogP of 1.82, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)thiatriazol-5-amine is sourced from PubChem (CID 718655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).