N-pyridin-3-ylthiatriazol-5-amine

C6H5N5S — CID 12638193

IUPACN-pyridin-3-ylthiatriazol-5-amine
SMILESc1cncc(Nc2nnns2)c1
InChIInChI=1S/C6H5N5S/c1-2-5(4-7-3-1)8-6-9-10-11-12-6/h1-4H,(H,8,9,11)
InChIKeyJZBOENIJMQEHQM-UHFFFAOYSA-N
MW179.21 g/mol
LogP1.07
Rot. Bonds2

About N-pyridin-3-ylthiatriazol-5-amine

N-pyridin-3-ylthiatriazol-5-amine (PubChem CID 12638193) has the molecular formula C6H5N5S and a molecular weight of 179.21 g/mol. Its IUPAC name is N-pyridin-3-ylthiatriazol-5-amine.

Molecular Properties

Compound NameN-pyridin-3-ylthiatriazol-5-amine
PubChem CID12638193
Molecular FormulaC6H5N5S
Molecular Weight179.21 g/mol
Exact Mass179.03
IUPAC NameN-pyridin-3-ylthiatriazol-5-amine
SMILESc1cncc(Nc2nnns2)c1
InChIInChI=1S/C6H5N5S/c1-2-5(4-7-3-1)8-6-9-10-11-12-6/h1-4H,(H,8,9,11)
InChIKeyJZBOENIJMQEHQM-UHFFFAOYSA-N
XLogP1.07
TPSA63.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.21
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-pyridin-3-ylthiatriazol-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-pyridin-3-ylthiadiazol-5-amine
CID 12638188
5-methyl-N-pyridin-3-yl-1,3,4-thiadiazol-2-amine
CID 2725837
N-pyridin-3-ylpyrimidin-2-amine
CID 11593513
N,4-dipyridin-3-yl-1,3-thiazol-2-amine
CID 2215784
2-(pyridin-3-ylamino)-1,3-thiazole-5-carboxylic acid
CID 80570815
(pyridin-3-ylamino)mercury(1+)
CID 16685218
N-fluoropyridin-3-amine
CID 141274626
N-bromopyridin-3-amine
CID 87128938
2-N-pyridin-3-ylpyridine-2,5-diamine
CID 4764177
5-(4-phenylphenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine;hydrobromide
CID 134103716
6-fluoro-N-pyridin-3-yl-1,3-benzothiazol-2-amine
CID 79144359
4-(2,2-dimethylpropyl)-N-pyridin-3-yl-1,3-thiazol-2-amine
CID 23988926

Frequently Asked Questions

What is the IUPAC name of N-pyridin-3-ylthiatriazol-5-amine?
The IUPAC name of N-pyridin-3-ylthiatriazol-5-amine (CID 12638193) is N-pyridin-3-ylthiatriazol-5-amine.
What is the SMILES notation for N-pyridin-3-ylthiatriazol-5-amine?
The canonical SMILES for N-pyridin-3-ylthiatriazol-5-amine is c1cncc(Nc2nnns2)c1.
What is the InChIKey of N-pyridin-3-ylthiatriazol-5-amine?
The InChIKey is JZBOENIJMQEHQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5N5S/c1-2-5(4-7-3-1)8-6-9-10-11-12-6/h1-4H,(H,8,9,11).
What are the key properties of N-pyridin-3-ylthiatriazol-5-amine?
N-pyridin-3-ylthiatriazol-5-amine has a molecular weight of 179.21 g/mol, XLogP of 1.07, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyridin-3-ylthiatriazol-5-amine is sourced from PubChem (CID 12638193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).