2,5-dichloro-N-(2-fluorophenyl)thiophene-3-carboxamide

C11H6Cl2FNOS — CID 2805352

IUPAC2,5-dichloro-N-(2-fluorophenyl)thiophene-3-carboxamide
SMILESO=C(Nc1ccccc1F)c1cc(Cl)sc1Cl
InChIInChI=1S/C11H6Cl2FNOS/c12-9-5-6(10(13)17-9)11(16)15-8-4-2-1-3-7(8)14/h1-5H,(H,15,16)
InChIKeyBRYVNBXPOBJSOP-UHFFFAOYSA-N
MW290.15 g/mol
LogP4.45
Rot. Bonds2

About 2,5-dichloro-N-(2-fluorophenyl)thiophene-3-carboxamide

2,5-dichloro-N-(2-fluorophenyl)thiophene-3-carboxamide (PubChem CID 2805352) has the molecular formula C11H6Cl2FNOS and a molecular weight of 290.15 g/mol. Its IUPAC name is 2,5-dichloro-N-(2-fluorophenyl)thiophene-3-carboxamide.

Molecular Properties

Compound Name2,5-dichloro-N-(2-fluorophenyl)thiophene-3-carboxamide
PubChem CID2805352
Molecular FormulaC11H6Cl2FNOS
Molecular Weight290.15 g/mol
Exact Mass288.95
IUPAC Name2,5-dichloro-N-(2-fluorophenyl)thiophene-3-carboxamide
SMILESO=C(Nc1ccccc1F)c1cc(Cl)sc1Cl
InChIInChI=1S/C11H6Cl2FNOS/c12-9-5-6(10(13)17-9)11(16)15-8-4-2-1-3-7(8)14/h1-5H,(H,15,16)
InChIKeyBRYVNBXPOBJSOP-UHFFFAOYSA-N
XLogP4.45
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.15
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N-(2-fluorophenyl)thiophene-3-carboxamide?
The IUPAC name of 2,5-dichloro-N-(2-fluorophenyl)thiophene-3-carboxamide (CID 2805352) is 2,5-dichloro-N-(2-fluorophenyl)thiophene-3-carboxamide.
What is the SMILES notation for 2,5-dichloro-N-(2-fluorophenyl)thiophene-3-carboxamide?
The canonical SMILES for 2,5-dichloro-N-(2-fluorophenyl)thiophene-3-carboxamide is O=C(Nc1ccccc1F)c1cc(Cl)sc1Cl.
What is the InChIKey of 2,5-dichloro-N-(2-fluorophenyl)thiophene-3-carboxamide?
The InChIKey is BRYVNBXPOBJSOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6Cl2FNOS/c12-9-5-6(10(13)17-9)11(16)15-8-4-2-1-3-7(8)14/h1-5H,(H,15,16).
What are the key properties of 2,5-dichloro-N-(2-fluorophenyl)thiophene-3-carboxamide?
2,5-dichloro-N-(2-fluorophenyl)thiophene-3-carboxamide has a molecular weight of 290.15 g/mol, XLogP of 4.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-N-(2-fluorophenyl)thiophene-3-carboxamide is sourced from PubChem (CID 2805352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).