N-[4-[(2,3,5,6-tetrafluoro-4-pyridinyl)oxy]phenyl]thiophene-3-carboxamide

C16H8F4N2O2S — CID 133372305

IUPACN-[4-[(2,3,5,6-tetrafluoro-4-pyridinyl)oxy]phenyl]thiophene-3-carboxamide
SMILESO=C(Nc1ccc(Oc2c(F)c(F)nc(F)c2F)cc1)c1ccsc1
InChIInChI=1S/C16H8F4N2O2S/c17-11-13(12(18)15(20)22-14(11)19)24-10-3-1-9(2-4-10)21-16(23)8-5-6-25-7-8/h1-7H,(H,21,23)
InChIKeyAYGLCHOPXFUNEM-UHFFFAOYSA-N
MW368.31 g/mol
LogP4.74
Rot. Bonds4

About N-[4-[(2,3,5,6-tetrafluoro-4-pyridinyl)oxy]phenyl]thiophene-3-carboxamide

N-[4-[(2,3,5,6-tetrafluoro-4-pyridinyl)oxy]phenyl]thiophene-3-carboxamide (PubChem CID 133372305) has the molecular formula C16H8F4N2O2S and a molecular weight of 368.31 g/mol. Its IUPAC name is N-[4-[(2,3,5,6-tetrafluoro-4-pyridinyl)oxy]phenyl]thiophene-3-carboxamide.

Molecular Properties

Compound NameN-[4-[(2,3,5,6-tetrafluoro-4-pyridinyl)oxy]phenyl]thiophene-3-carboxamide
PubChem CID133372305
Molecular FormulaC16H8F4N2O2S
Molecular Weight368.31 g/mol
Exact Mass368.02
IUPAC NameN-[4-[(2,3,5,6-tetrafluoro-4-pyridinyl)oxy]phenyl]thiophene-3-carboxamide
SMILESO=C(Nc1ccc(Oc2c(F)c(F)nc(F)c2F)cc1)c1ccsc1
InChIInChI=1S/C16H8F4N2O2S/c17-11-13(12(18)15(20)22-14(11)19)24-10-3-1-9(2-4-10)21-16(23)8-5-6-25-7-8/h1-7H,(H,21,23)
InChIKeyAYGLCHOPXFUNEM-UHFFFAOYSA-N
XLogP4.74
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.31
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N-[4-[6-(4-fluorophenyl)pyridazin-3-yl]oxyphenyl]thiophene-3-carboxamide
CID 133288175
N-[4-(2-cyano-3-fluorophenoxy)phenyl]thiophene-3-carboxamide
CID 133288211
N-(6-fluoro-3-pyridinyl)thiophene-3-carboxamide
CID 103789756
N-[4-(2-methyl-6-pyrrol-1-ylpyrimidin-4-yl)oxyphenyl]thiophene-3-carboxamide
CID 122309355
N-(4-acetylphenyl)thiophene-3-carboxamide
CID 24703153
N-[4-[2,3,5,6-tetrafluoro-4-[4-(thiophene-2-carbonylamino)phenoxy]phenoxy]phenyl]thiophene-2-carboxamide
CID 2307498
N-[4-(2,4-dinitrophenoxy)phenyl]thiophene-3-carboxamide
CID 133299347
N-[4-(6-imidazol-1-ylpyrimidin-4-yl)oxyphenyl]thiophene-3-carboxamide
CID 122312000
N-pyrimidin-5-ylthiophene-3-carboxamide
CID 91557121
N-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]thiophene-3-carboxamide
CID 24711478
N-[4-(4-cyano-5,6-diethylpyridazin-3-yl)oxyphenyl]thiophene-3-carboxamide
CID 133378964
N-[2-[(4-propan-2-yloxyphenyl)carbamoyl]phenyl]thiophene-3-carboxamide
CID 60555404

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2,3,5,6-tetrafluoro-4-pyridinyl)oxy]phenyl]thiophene-3-carboxamide?
The IUPAC name of N-[4-[(2,3,5,6-tetrafluoro-4-pyridinyl)oxy]phenyl]thiophene-3-carboxamide (CID 133372305) is N-[4-[(2,3,5,6-tetrafluoro-4-pyridinyl)oxy]phenyl]thiophene-3-carboxamide.
What is the SMILES notation for N-[4-[(2,3,5,6-tetrafluoro-4-pyridinyl)oxy]phenyl]thiophene-3-carboxamide?
The canonical SMILES for N-[4-[(2,3,5,6-tetrafluoro-4-pyridinyl)oxy]phenyl]thiophene-3-carboxamide is O=C(Nc1ccc(Oc2c(F)c(F)nc(F)c2F)cc1)c1ccsc1.
What is the InChIKey of N-[4-[(2,3,5,6-tetrafluoro-4-pyridinyl)oxy]phenyl]thiophene-3-carboxamide?
The InChIKey is AYGLCHOPXFUNEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H8F4N2O2S/c17-11-13(12(18)15(20)22-14(11)19)24-10-3-1-9(2-4-10)21-16(23)8-5-6-25-7-8/h1-7H,(H,21,23).
What are the key properties of N-[4-[(2,3,5,6-tetrafluoro-4-pyridinyl)oxy]phenyl]thiophene-3-carboxamide?
N-[4-[(2,3,5,6-tetrafluoro-4-pyridinyl)oxy]phenyl]thiophene-3-carboxamide has a molecular weight of 368.31 g/mol, XLogP of 4.74, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2,3,5,6-tetrafluoro-4-pyridinyl)oxy]phenyl]thiophene-3-carboxamide is sourced from PubChem (CID 133372305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).