N-(2-fluorophenyl)-4-thiophen-2-ylthiadiazole-5-carboxamide

C13H8FN3OS2 — CID 100751885

IUPACN-(2-fluorophenyl)-4-thiophen-2-ylthiadiazole-5-carboxamide
SMILESO=C(Nc1ccccc1F)c1snnc1-c1cccs1
InChIInChI=1S/C13H8FN3OS2/c14-8-4-1-2-5-9(8)15-13(18)12-11(16-17-20-12)10-6-3-7-19-10/h1-7H,(H,15,18)
InChIKeyGNPZAWUAARISME-UHFFFAOYSA-N
MW305.36 g/mol
LogP3.66
Rot. Bonds3

About N-(2-fluorophenyl)-4-thiophen-2-ylthiadiazole-5-carboxamide

N-(2-fluorophenyl)-4-thiophen-2-ylthiadiazole-5-carboxamide (PubChem CID 100751885) has the molecular formula C13H8FN3OS2 and a molecular weight of 305.36 g/mol. Its IUPAC name is N-(2-fluorophenyl)-4-thiophen-2-ylthiadiazole-5-carboxamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-4-thiophen-2-ylthiadiazole-5-carboxamide
PubChem CID100751885
Molecular FormulaC13H8FN3OS2
Molecular Weight305.36 g/mol
Exact Mass305.01
IUPAC NameN-(2-fluorophenyl)-4-thiophen-2-ylthiadiazole-5-carboxamide
SMILESO=C(Nc1ccccc1F)c1snnc1-c1cccs1
InChIInChI=1S/C13H8FN3OS2/c14-8-4-1-2-5-9(8)15-13(18)12-11(16-17-20-12)10-6-3-7-19-10/h1-7H,(H,15,18)
InChIKeyGNPZAWUAARISME-UHFFFAOYSA-N
XLogP3.66
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.36
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-fluorophenyl)-4-thiophen-2-ylthiadiazole-5-carboxamide
CID 100751902
N-(3-chloro-4-fluorophenyl)-4-thiophen-2-ylthiadiazole-5-carboxamide
CID 100752070
N-(4-chlorophenyl)-4-thiophen-2-ylthiadiazole-5-carboxamide
CID 100751925
N-benzyl-4-thiophen-2-ylthiadiazole-5-carboxamide
CID 100751617
N-(3-chlorophenyl)-4-thiophen-2-ylthiadiazole-5-carboxamide
CID 100751917
N-[(2S)-butan-2-yl]-4-thiophen-2-ylthiadiazole-5-carboxamide
CID 100751536
N-(2-bromophenyl)-4-(4-fluorophenyl)thiadiazole-5-carboxamide
CID 100749567
N-(2-fluorophenyl)-1-methyl-5-thiophen-2-ylpyrazole-3-carboxamide
CID 110336071
N-(2-fluorophenyl)-6-thiophen-2-ylimidazo[2,1-b][1,3]thiazole-3-carboxamide
CID 42271089
N-(2-fluorophenyl)-1-(4-fluorophenyl)-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide
CID 41466857
3-[2-[(2-fluorophenyl)carbamoyl]thiophen-3-yl]prop-2-enoic acid
CID 77007163
4-fluoro-3-methyl-N-(2-thiophen-2-ylphenyl)-1-benzothiophene-2-carboxamide
CID 24568109

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-4-thiophen-2-ylthiadiazole-5-carboxamide?
The IUPAC name of N-(2-fluorophenyl)-4-thiophen-2-ylthiadiazole-5-carboxamide (CID 100751885) is N-(2-fluorophenyl)-4-thiophen-2-ylthiadiazole-5-carboxamide.
What is the SMILES notation for N-(2-fluorophenyl)-4-thiophen-2-ylthiadiazole-5-carboxamide?
The canonical SMILES for N-(2-fluorophenyl)-4-thiophen-2-ylthiadiazole-5-carboxamide is O=C(Nc1ccccc1F)c1snnc1-c1cccs1.
What is the InChIKey of N-(2-fluorophenyl)-4-thiophen-2-ylthiadiazole-5-carboxamide?
The InChIKey is GNPZAWUAARISME-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8FN3OS2/c14-8-4-1-2-5-9(8)15-13(18)12-11(16-17-20-12)10-6-3-7-19-10/h1-7H,(H,15,18).
What are the key properties of N-(2-fluorophenyl)-4-thiophen-2-ylthiadiazole-5-carboxamide?
N-(2-fluorophenyl)-4-thiophen-2-ylthiadiazole-5-carboxamide has a molecular weight of 305.36 g/mol, XLogP of 3.66, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-4-thiophen-2-ylthiadiazole-5-carboxamide is sourced from PubChem (CID 100751885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).