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

C11H5Cl2F2NOS — CID 51191647

IUPAC2,5-dichloro-N-(2,5-difluorophenyl)thiophene-3-carboxamide
SMILESO=C(Nc1cc(F)ccc1F)c1cc(Cl)sc1Cl
InChIInChI=1S/C11H5Cl2F2NOS/c12-9-4-6(10(13)18-9)11(17)16-8-3-5(14)1-2-7(8)15/h1-4H,(H,16,17)
InChIKeyPMZKXOIJTNWFAN-UHFFFAOYSA-N
MW308.14 g/mol
LogP4.59
Rot. Bonds2

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

2,5-dichloro-N-(2,5-difluorophenyl)thiophene-3-carboxamide (PubChem CID 51191647) has the molecular formula C11H5Cl2F2NOS and a molecular weight of 308.14 g/mol. Its IUPAC name is 2,5-dichloro-N-(2,5-difluorophenyl)thiophene-3-carboxamide.

Molecular Properties

Compound Name2,5-dichloro-N-(2,5-difluorophenyl)thiophene-3-carboxamide
PubChem CID51191647
Molecular FormulaC11H5Cl2F2NOS
Molecular Weight308.14 g/mol
Exact Mass306.94
IUPAC Name2,5-dichloro-N-(2,5-difluorophenyl)thiophene-3-carboxamide
SMILESO=C(Nc1cc(F)ccc1F)c1cc(Cl)sc1Cl
InChIInChI=1S/C11H5Cl2F2NOS/c12-9-4-6(10(13)18-9)11(17)16-8-3-5(14)1-2-7(8)15/h1-4H,(H,16,17)
InChIKeyPMZKXOIJTNWFAN-UHFFFAOYSA-N
XLogP4.59
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.14
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bromo-5-fluorophenyl)-2,5-dichlorothiophene-3-carboxamide
CID 113255459
2-chloro-N-(2,5-difluorophenyl)-4-fluorobenzamide
CID 26361023
N-(5-chloro-2-fluorophenyl)-2,4-difluorobenzamide
CID 7899666
4-chloro-N-(2,5-difluorophenyl)benzamide
CID 2969912
5-chloro-N-(2,5-difluorophenyl)-2-(methylamino)benzamide
CID 62172768
N-(2,5-difluorophenyl)-2,3,4-trifluorobenzamide
CID 28560277
2-bromo-N-(2,5-difluorophenyl)-4-fluorobenzamide
CID 24710516
3-chloro-N-(2,5-difluorophenyl)-6-fluoro-1-benzothiophene-2-carboxamide
CID 3424498
N-(2-amino-6-fluorophenyl)-2,5-dichlorothiophene-3-carboxamide
CID 107959517
2-chloro-N-(2,5-difluorophenyl)-5-nitrobenzamide
CID 7770244
(2-chloro-4-fluorophenyl)-(2,5-dichlorothiophen-3-yl)methanone
CID 43344763
1-(2,5-dichlorothiophen-3-yl)-3-(2,4-difluorophenyl)urea
CID 2805628

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N-(2,5-difluorophenyl)thiophene-3-carboxamide?
The IUPAC name of 2,5-dichloro-N-(2,5-difluorophenyl)thiophene-3-carboxamide (CID 51191647) is 2,5-dichloro-N-(2,5-difluorophenyl)thiophene-3-carboxamide.
What is the SMILES notation for 2,5-dichloro-N-(2,5-difluorophenyl)thiophene-3-carboxamide?
The canonical SMILES for 2,5-dichloro-N-(2,5-difluorophenyl)thiophene-3-carboxamide is O=C(Nc1cc(F)ccc1F)c1cc(Cl)sc1Cl.
What is the InChIKey of 2,5-dichloro-N-(2,5-difluorophenyl)thiophene-3-carboxamide?
The InChIKey is PMZKXOIJTNWFAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H5Cl2F2NOS/c12-9-4-6(10(13)18-9)11(17)16-8-3-5(14)1-2-7(8)15/h1-4H,(H,16,17).
What are the key properties of 2,5-dichloro-N-(2,5-difluorophenyl)thiophene-3-carboxamide?
2,5-dichloro-N-(2,5-difluorophenyl)thiophene-3-carboxamide has a molecular weight of 308.14 g/mol, XLogP of 4.59, 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-(2,5-difluorophenyl)thiophene-3-carboxamide is sourced from PubChem (CID 51191647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).