N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide

C5H4N6OS — CID 84554106

IUPACN-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide
SMILESO=C(Nc1nn[nH]n1)c1cscn1
InChIInChI=1S/C5H4N6OS/c12-4(3-1-13-2-6-3)7-5-8-10-11-9-5/h1-2H,(H2,7,8,9,10,11,12)
InChIKeyLAXMPLGLIZTXNT-UHFFFAOYSA-N
MW196.20 g/mol
LogP-0.09
Rot. Bonds2

About N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide

N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide (PubChem CID 84554106) has the molecular formula C5H4N6OS and a molecular weight of 196.20 g/mol. Its IUPAC name is N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide
PubChem CID84554106
Molecular FormulaC5H4N6OS
Molecular Weight196.20 g/mol
Exact Mass196.02
IUPAC NameN-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide
SMILESO=C(Nc1nn[nH]n1)c1cscn1
InChIInChI=1S/C5H4N6OS/c12-4(3-1-13-2-6-3)7-5-8-10-11-9-5/h1-2H,(H2,7,8,9,10,11,12)
InChIKeyLAXMPLGLIZTXNT-UHFFFAOYSA-N
XLogP-0.09
TPSA96.45 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.20
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-methyl-1,3-thiazole-4-carboxamide;dihydrochloride
CID 175705206
N-(2-amino-2-oxoethoxy)-1,3-thiazole-4-carboxamide
CID 112550667
N-phenyl-1,3-thiazole-4-carboxamide
CID 62045972
N-[4-(2-amino-2-oxoethoxy)phenyl]-1,3-thiazole-4-carboxamide
CID 62045992
3,5-diiodo-N-(2H-tetrazol-5-yl)benzamide
CID 3027075
N-(4-carbamoyl-1H-pyrazol-5-yl)-1,3-thiazole-4-carboxamide
CID 110471775
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1,3-thiazole-4-carboxamide
CID 110462181
N-[(E)-4-chlorobut-2-enyl]-1,3-thiazole-4-carboxamide
CID 81428963
2-(1,3-thiazole-4-carbonylamino)oxyacetic acid
CID 63913381
2-(furan-2-yl)-N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide
CID 15623144
N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]-1,3-thiazole-4-carboxamide
CID 84561012
N-prop-2-enyl-1,3-thiazole-4-carboxamide
CID 63038406

Frequently Asked Questions

What is the IUPAC name of N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide?
The IUPAC name of N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide (CID 84554106) is N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide is O=C(Nc1nn[nH]n1)c1cscn1.
What is the InChIKey of N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide?
The InChIKey is LAXMPLGLIZTXNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4N6OS/c12-4(3-1-13-2-6-3)7-5-8-10-11-9-5/h1-2H,(H2,7,8,9,10,11,12).
What are the key properties of N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide?
N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide has a molecular weight of 196.20 g/mol, XLogP of -0.09, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 84554106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).