N-(thiadiazol-5-yl)-2H-tetrazole-5-carboxamide

C4H3N7OS — CID 114913673

IUPACN-(thiadiazol-5-yl)-2H-tetrazole-5-carboxamide
SMILESO=C(Nc1cnns1)c1nn[nH]n1
InChIInChI=1S/C4H3N7OS/c12-4(3-7-9-10-8-3)6-2-1-5-11-13-2/h1H,(H,6,12)(H,7,8,9,10)
InChIKeyMWQUAAYZDNKOQH-UHFFFAOYSA-N
MW197.18 g/mol
LogP-0.70
Rot. Bonds2

About N-(thiadiazol-5-yl)-2H-tetrazole-5-carboxamide

N-(thiadiazol-5-yl)-2H-tetrazole-5-carboxamide (PubChem CID 114913673) has the molecular formula C4H3N7OS and a molecular weight of 197.18 g/mol. Its IUPAC name is N-(thiadiazol-5-yl)-2H-tetrazole-5-carboxamide.

Molecular Properties

Compound NameN-(thiadiazol-5-yl)-2H-tetrazole-5-carboxamide
PubChem CID114913673
Molecular FormulaC4H3N7OS
Molecular Weight197.18 g/mol
Exact Mass197.01
IUPAC NameN-(thiadiazol-5-yl)-2H-tetrazole-5-carboxamide
SMILESO=C(Nc1cnns1)c1nn[nH]n1
InChIInChI=1S/C4H3N7OS/c12-4(3-7-9-10-8-3)6-2-1-5-11-13-2/h1H,(H,6,12)(H,7,8,9,10)
InChIKeyMWQUAAYZDNKOQH-UHFFFAOYSA-N
XLogP-0.70
TPSA109.34 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.18
LogP ≤ 5-0.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze N-(thiadiazol-5-yl)-2H-tetrazole-5-carboxamide 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

5-tert-butyl-N-(thiadiazol-5-yl)-1H-1,2,4-triazole-3-carboxamide
CID 114913663
4-hydroxy-N-(thiadiazol-5-yl)benzamide
CID 114912827
4-amino-5-methyl-N-(thiadiazol-5-yl)-1H-pyrazole-3-carboxamide
CID 114911500
3-amino-N-(thiadiazol-5-yl)benzamide
CID 114911458
1-(2-fluoroethyl)-3-(thiadiazol-5-yl)urea
CID 130668369
2,4-dibromo-N-(thiadiazol-5-yl)benzamide
CID 103282575
3-bromo-N-(thiadiazol-5-yl)propanamide
CID 114912011
1-(4-fluorophenyl)-3-(thiadiazol-5-yl)urea
CID 11379409
3-chloro-N-(thiadiazol-5-ylcarbamoyl)propanamide
CID 107649871
2-hydroxy-3-methyl-N-(thiadiazol-5-yl)benzamide
CID 114912821
1-(4-sulfanylidenebutyl)-3-(thiadiazol-5-yl)urea
CID 118947664
2-[(2-methylpropan-2-yl)oxy]-N-(thiadiazol-5-yl)acetamide
CID 103282568

Frequently Asked Questions

What is the IUPAC name of N-(thiadiazol-5-yl)-2H-tetrazole-5-carboxamide?
The IUPAC name of N-(thiadiazol-5-yl)-2H-tetrazole-5-carboxamide (CID 114913673) is N-(thiadiazol-5-yl)-2H-tetrazole-5-carboxamide.
What is the SMILES notation for N-(thiadiazol-5-yl)-2H-tetrazole-5-carboxamide?
The canonical SMILES for N-(thiadiazol-5-yl)-2H-tetrazole-5-carboxamide is O=C(Nc1cnns1)c1nn[nH]n1.
What is the InChIKey of N-(thiadiazol-5-yl)-2H-tetrazole-5-carboxamide?
The InChIKey is MWQUAAYZDNKOQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H3N7OS/c12-4(3-7-9-10-8-3)6-2-1-5-11-13-2/h1H,(H,6,12)(H,7,8,9,10).
What are the key properties of N-(thiadiazol-5-yl)-2H-tetrazole-5-carboxamide?
N-(thiadiazol-5-yl)-2H-tetrazole-5-carboxamide has a molecular weight of 197.18 g/mol, XLogP of -0.70, 2 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(thiadiazol-5-yl)-2H-tetrazole-5-carboxamide is sourced from PubChem (CID 114913673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).