2-amino-N-(thiadiazol-4-yl)-1,3-thiazole-4-carboxamide

C6H5N5OS2 — CID 164656956

IUPAC2-amino-N-(thiadiazol-4-yl)-1,3-thiazole-4-carboxamide
SMILESNc1nc(C(=O)Nc2csnn2)cs1
InChIInChI=1S/C6H5N5OS2/c7-6-8-3(1-13-6)5(12)9-4-2-14-11-10-4/h1-2H,(H2,7,8)(H,9,12)
InChIKeyUGLOSILRCVYFFX-UHFFFAOYSA-N
MW227.27 g/mol
LogP0.83
Rot. Bonds2

About 2-amino-N-(thiadiazol-4-yl)-1,3-thiazole-4-carboxamide

2-amino-N-(thiadiazol-4-yl)-1,3-thiazole-4-carboxamide (PubChem CID 164656956) has the molecular formula C6H5N5OS2 and a molecular weight of 227.27 g/mol. Its IUPAC name is 2-amino-N-(thiadiazol-4-yl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-(thiadiazol-4-yl)-1,3-thiazole-4-carboxamide
PubChem CID164656956
Molecular FormulaC6H5N5OS2
Molecular Weight227.27 g/mol
Exact Mass226.99
IUPAC Name2-amino-N-(thiadiazol-4-yl)-1,3-thiazole-4-carboxamide
SMILESNc1nc(C(=O)Nc2csnn2)cs1
InChIInChI=1S/C6H5N5OS2/c7-6-8-3(1-13-6)5(12)9-4-2-14-11-10-4/h1-2H,(H2,7,8)(H,9,12)
InChIKeyUGLOSILRCVYFFX-UHFFFAOYSA-N
XLogP0.83
TPSA93.79 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.27
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-amino-N-pyridazin-3-yl-1,3-thiazole-4-carboxamide
CID 116786705
2-amino-N-(5-methyl-1H-pyrazol-3-yl)-1,3-thiazole-4-carboxamide
CID 63823171
2-amino-N-(2,4,6-tribromophenyl)-1,3-thiazole-4-carboxamide
CID 62786642
2-amino-N-(thiadiazol-4-yl)acetamide
CID 164646379
2-amino-N-(6-phenylpyrazin-2-yl)-1,3-thiazole-4-carboxamide
CID 141488082
2-amino-N-(5,6-diethyl-1,2,4-triazin-3-yl)-1,3-thiazole-4-carboxamide
CID 114387594
2-amino-N-(1-amino-2-methyl-1-oxopropan-2-yl)-1,3-thiazole-4-carboxamide
CID 62788446
2-amino-N-(4-bromo-2,6-dichlorophenyl)-1,3-thiazole-4-carboxamide
CID 55116387
N-(4-acetylphenyl)-2-amino-1,3-thiazole-4-carboxamide
CID 62787747
2-amino-N-(2,6-dibromo-4-chlorophenyl)-1,3-thiazole-4-carboxamide
CID 114209117
2-amino-N-[4-(methylcarbamoyl)phenyl]-1,3-thiazole-4-carboxamide
CID 62788909
2-amino-N-(2,6-diethylphenyl)-1,3-thiazole-4-carboxamide
CID 55115870

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(thiadiazol-4-yl)-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-amino-N-(thiadiazol-4-yl)-1,3-thiazole-4-carboxamide (CID 164656956) is 2-amino-N-(thiadiazol-4-yl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-amino-N-(thiadiazol-4-yl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-amino-N-(thiadiazol-4-yl)-1,3-thiazole-4-carboxamide is Nc1nc(C(=O)Nc2csnn2)cs1.
What is the InChIKey of 2-amino-N-(thiadiazol-4-yl)-1,3-thiazole-4-carboxamide?
The InChIKey is UGLOSILRCVYFFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5N5OS2/c7-6-8-3(1-13-6)5(12)9-4-2-14-11-10-4/h1-2H,(H2,7,8)(H,9,12).
What are the key properties of 2-amino-N-(thiadiazol-4-yl)-1,3-thiazole-4-carboxamide?
2-amino-N-(thiadiazol-4-yl)-1,3-thiazole-4-carboxamide has a molecular weight of 227.27 g/mol, XLogP of 0.83, 2 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(thiadiazol-4-yl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 164656956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).