4-amino-N-(thiatriazol-5-yl)pyridine-3-carboxamide

C7H6N6OS — CID 114914399

IUPAC4-amino-N-(thiatriazol-5-yl)pyridine-3-carboxamide
SMILESNc1ccncc1C(=O)Nc1nnns1
InChIInChI=1S/C7H6N6OS/c8-5-1-2-9-3-4(5)6(14)10-7-11-12-13-15-7/h1-3H,(H2,8,9)(H,10,11,13,14)
InChIKeyZHXXZPSZAPEIRE-UHFFFAOYSA-N
MW222.23 g/mol
LogP0.16
Rot. Bonds2

About 4-amino-N-(thiatriazol-5-yl)pyridine-3-carboxamide

4-amino-N-(thiatriazol-5-yl)pyridine-3-carboxamide (PubChem CID 114914399) has the molecular formula C7H6N6OS and a molecular weight of 222.23 g/mol. Its IUPAC name is 4-amino-N-(thiatriazol-5-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(thiatriazol-5-yl)pyridine-3-carboxamide
PubChem CID114914399
Molecular FormulaC7H6N6OS
Molecular Weight222.23 g/mol
Exact Mass222.03
IUPAC Name4-amino-N-(thiatriazol-5-yl)pyridine-3-carboxamide
SMILESNc1ccncc1C(=O)Nc1nnns1
InChIInChI=1S/C7H6N6OS/c8-5-1-2-9-3-4(5)6(14)10-7-11-12-13-15-7/h1-3H,(H2,8,9)(H,10,11,13,14)
InChIKeyZHXXZPSZAPEIRE-UHFFFAOYSA-N
XLogP0.16
TPSA106.68 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.23
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

4-chloro-N-(thiatriazol-5-yl)pyridine-3-carboxamide
CID 114912098
2-amino-N-(thiatriazol-5-yl)-5-(trifluoromethyl)benzamide
CID 114914384
2-amino-5-bromo-N-(thiatriazol-5-yl)pyridine-3-carboxamide
CID 114914283
4-amino-N-pyridin-2-ylpyridine-3-carboxamide
CID 81236875
5-bromo-2-chloro-N-(thiatriazol-5-yl)benzamide
CID 114912771
2-bromo-4-fluoro-N-(thiatriazol-5-yl)benzamide
CID 114912800
4-amino-N-(3,5-dichloro-4-fluorophenyl)pyridine-3-carboxamide
CID 107578409
4-amino-N-(1-amino-1-oxopropan-2-yl)pyridine-3-carboxamide
CID 81243304
4-amino-N-(2,6-diethylphenyl)pyridine-3-carboxamide
CID 81235051
4-amino-N-(4-bromo-2,6-difluorophenyl)pyridine-3-carboxamide
CID 81245018
4-amino-N-(3-bromo-2-pyridinyl)pyridine-3-carboxamide
CID 81245467
3-hydroxy-N-(thiatriazol-5-yl)naphthalene-2-carboxamide
CID 114912843

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(thiatriazol-5-yl)pyridine-3-carboxamide?
The IUPAC name of 4-amino-N-(thiatriazol-5-yl)pyridine-3-carboxamide (CID 114914399) is 4-amino-N-(thiatriazol-5-yl)pyridine-3-carboxamide.
What is the SMILES notation for 4-amino-N-(thiatriazol-5-yl)pyridine-3-carboxamide?
The canonical SMILES for 4-amino-N-(thiatriazol-5-yl)pyridine-3-carboxamide is Nc1ccncc1C(=O)Nc1nnns1.
What is the InChIKey of 4-amino-N-(thiatriazol-5-yl)pyridine-3-carboxamide?
The InChIKey is ZHXXZPSZAPEIRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N6OS/c8-5-1-2-9-3-4(5)6(14)10-7-11-12-13-15-7/h1-3H,(H2,8,9)(H,10,11,13,14).
What are the key properties of 4-amino-N-(thiatriazol-5-yl)pyridine-3-carboxamide?
4-amino-N-(thiatriazol-5-yl)pyridine-3-carboxamide has a molecular weight of 222.23 g/mol, XLogP of 0.16, 2 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(thiatriazol-5-yl)pyridine-3-carboxamide is sourced from PubChem (CID 114914399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).