2-chloro-N-(2,5-difluorophenyl)-4-fluorobenzamide

C13H7ClF3NO — CID 26361023

IUPAC2-chloro-N-(2,5-difluorophenyl)-4-fluorobenzamide
SMILESO=C(Nc1cc(F)ccc1F)c1ccc(F)cc1Cl
InChIInChI=1S/C13H7ClF3NO/c14-10-5-7(15)1-3-9(10)13(19)18-12-6-8(16)2-4-11(12)17/h1-6H,(H,18,19)
InChIKeyXEWJTQQLPGRBJL-UHFFFAOYSA-N
MW285.65 g/mol
LogP4.01
Rot. Bonds2

About 2-chloro-N-(2,5-difluorophenyl)-4-fluorobenzamide

2-chloro-N-(2,5-difluorophenyl)-4-fluorobenzamide (PubChem CID 26361023) has the molecular formula C13H7ClF3NO and a molecular weight of 285.65 g/mol. Its IUPAC name is 2-chloro-N-(2,5-difluorophenyl)-4-fluorobenzamide.

Molecular Properties

Compound Name2-chloro-N-(2,5-difluorophenyl)-4-fluorobenzamide
PubChem CID26361023
Molecular FormulaC13H7ClF3NO
Molecular Weight285.65 g/mol
Exact Mass285.02
IUPAC Name2-chloro-N-(2,5-difluorophenyl)-4-fluorobenzamide
SMILESO=C(Nc1cc(F)ccc1F)c1ccc(F)cc1Cl
InChIInChI=1S/C13H7ClF3NO/c14-10-5-7(15)1-3-9(10)13(19)18-12-6-8(16)2-4-11(12)17/h1-6H,(H,18,19)
InChIKeyXEWJTQQLPGRBJL-UHFFFAOYSA-N
XLogP4.01
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.65
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(5-chloro-2-fluorophenyl)-2,4-difluorobenzamide
CID 7899666
2,4-dichloro-N-(5-fluoro-2-methylphenyl)benzamide
CID 804177
N-(2,5-difluorophenyl)-2,3,4-trifluorobenzamide
CID 28560277
2-chloro-4-fluoro-N-(4-fluoro-2-methylphenyl)benzamide
CID 6468797
2-bromo-N-(2,5-difluorophenyl)-4-fluorobenzamide
CID 24710516
2,5-dichloro-N-(2,5-difluorophenyl)thiophene-3-carboxamide
CID 51191647
4-chloro-N-(2,5-difluorophenyl)benzamide
CID 2969912
5-chloro-N-(2,5-difluorophenyl)-2-(methylamino)benzamide
CID 62172768
N-(2-amino-4-methylphenyl)-2-chloro-4-fluorobenzamide
CID 43259104
2-chloro-N-(2,5-difluorophenyl)-5-nitrobenzamide
CID 7770244
2-chloro-4-fluoro-N-naphthalen-1-ylbenzamide
CID 26087324
4-amino-2-[(2-chloro-4-fluorobenzoyl)amino]benzoic acid
CID 63116238

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(2,5-difluorophenyl)-4-fluorobenzamide?
The IUPAC name of 2-chloro-N-(2,5-difluorophenyl)-4-fluorobenzamide (CID 26361023) is 2-chloro-N-(2,5-difluorophenyl)-4-fluorobenzamide.
What is the SMILES notation for 2-chloro-N-(2,5-difluorophenyl)-4-fluorobenzamide?
The canonical SMILES for 2-chloro-N-(2,5-difluorophenyl)-4-fluorobenzamide is O=C(Nc1cc(F)ccc1F)c1ccc(F)cc1Cl.
What is the InChIKey of 2-chloro-N-(2,5-difluorophenyl)-4-fluorobenzamide?
The InChIKey is XEWJTQQLPGRBJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7ClF3NO/c14-10-5-7(15)1-3-9(10)13(19)18-12-6-8(16)2-4-11(12)17/h1-6H,(H,18,19).
What are the key properties of 2-chloro-N-(2,5-difluorophenyl)-4-fluorobenzamide?
2-chloro-N-(2,5-difluorophenyl)-4-fluorobenzamide has a molecular weight of 285.65 g/mol, XLogP of 4.01, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(2,5-difluorophenyl)-4-fluorobenzamide is sourced from PubChem (CID 26361023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).