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

C9H6N6O2S — CID 15623144

IUPAC2-(furan-2-yl)-N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide
SMILESO=C(Nc1nn[nH]n1)c1csc(-c2ccco2)n1
InChIInChI=1S/C9H6N6O2S/c16-7(11-9-12-14-15-13-9)5-4-18-8(10-5)6-2-1-3-17-6/h1-4H,(H2,11,12,13,14,15,16)
InChIKeyGZNKIOHEHUFRKQ-UHFFFAOYSA-N
MW262.25 g/mol
LogP1.17
Rot. Bonds3

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

2-(furan-2-yl)-N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide (PubChem CID 15623144) has the molecular formula C9H6N6O2S and a molecular weight of 262.25 g/mol. Its IUPAC name is 2-(furan-2-yl)-N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-(furan-2-yl)-N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide
PubChem CID15623144
Molecular FormulaC9H6N6O2S
Molecular Weight262.25 g/mol
Exact Mass262.03
IUPAC Name2-(furan-2-yl)-N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide
SMILESO=C(Nc1nn[nH]n1)c1csc(-c2ccco2)n1
InChIInChI=1S/C9H6N6O2S/c16-7(11-9-12-14-15-13-9)5-4-18-8(10-5)6-2-1-3-17-6/h1-4H,(H2,11,12,13,14,15,16)
InChIKeyGZNKIOHEHUFRKQ-UHFFFAOYSA-N
XLogP1.17
TPSA109.59 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.25
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-aminoethanol;2-(furan-2-yl)-N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide
CID 15623145
2-(furan-2-yl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)-1,3-thiazole-4-carboxamide
CID 78927834
2-(2-methylphenyl)-N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide
CID 15623106
2-(furan-2-yl)-N-[4-(methylcarbamoyl)phenyl]-1,3-thiazole-4-carboxamide
CID 36769984
2-(furan-2-yl)-N-(4-methyl-1,3-thiazol-2-yl)-1,3-thiazole-4-carboxamide
CID 36703482
2-(furan-2-yl)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)-1,3-thiazole-4-carboxamide
CID 36808320
2-(furan-2-yl)-N-(5-propyl-1H-pyrazol-3-yl)-1,3-thiazole-4-carboxamide
CID 115619787
N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-(furan-2-yl)-1,3-thiazole-4-carboxamide
CID 32869605
2-(furan-2-yl)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)-1,3-thiazole-4-carboxamide
CID 36771348
N-ethoxy-2-(furan-2-yl)-1,3-thiazole-4-carboxamide
CID 36767453
N-(2-acetamidoethyl)-2-(furan-2-yl)-1,3-thiazole-4-carboxamide
CID 36709264
N-(3-fluorophenyl)-2-(furan-2-yl)-1,3-thiazole-4-carboxamide
CID 36654704

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-(furan-2-yl)-N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide (CID 15623144) is 2-(furan-2-yl)-N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-(furan-2-yl)-N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-(furan-2-yl)-N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide is O=C(Nc1nn[nH]n1)c1csc(-c2ccco2)n1.
What is the InChIKey of 2-(furan-2-yl)-N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide?
The InChIKey is GZNKIOHEHUFRKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6N6O2S/c16-7(11-9-12-14-15-13-9)5-4-18-8(10-5)6-2-1-3-17-6/h1-4H,(H2,11,12,13,14,15,16).
What are the key properties of 2-(furan-2-yl)-N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide?
2-(furan-2-yl)-N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide has a molecular weight of 262.25 g/mol, XLogP of 1.17, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 15623144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).