4-chloro-2,6-difluorobenzamide

C7H4ClF2NO — CID 22478130

IUPAC4-chloro-2,6-difluorobenzamide
SMILESNC(=O)c1c(F)cc(Cl)cc1F
InChIInChI=1S/C7H4ClF2NO/c8-3-1-4(9)6(7(11)12)5(10)2-3/h1-2H,(H2,11,12)
InChIKeyWYCJKDFBALNGMP-UHFFFAOYSA-N
MW191.56 g/mol
LogP1.72
Rot. Bonds1

About 4-chloro-2,6-difluorobenzamide

4-chloro-2,6-difluorobenzamide (PubChem CID 22478130) has the molecular formula C7H4ClF2NO and a molecular weight of 191.56 g/mol. Its IUPAC name is 4-chloro-2,6-difluorobenzamide.

Molecular Properties

Compound Name4-chloro-2,6-difluorobenzamide
PubChem CID22478130
Molecular FormulaC7H4ClF2NO
Molecular Weight191.56 g/mol
Exact Mass190.99
IUPAC Name4-chloro-2,6-difluorobenzamide
SMILESNC(=O)c1c(F)cc(Cl)cc1F
InChIInChI=1S/C7H4ClF2NO/c8-3-1-4(9)6(7(11)12)5(10)2-3/h1-2H,(H2,11,12)
InChIKeyWYCJKDFBALNGMP-UHFFFAOYSA-N
XLogP1.72
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.56
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,5-dichloro-3-fluorobenzamide
CID 121228309
4-chloro-3,6-difluoro-2-methylbenzamide
CID 177366314
(4-chloro-2,6-difluorophenyl)urea
CID 59083606
2-bromo-6-chloro-3-fluorobenzamide
CID 131617846
3-bromo-2,6-dichloro-5-fluorobenzamide
CID 141400879
CID 161042703
CID 161042703
2,4,6-tris(2,4,5-trifluorophenyl)benzene-1,3,5-tricarboxamide
CID 139330725
2,3,5-trifluorobenzene-1,4-dicarboxamide
CID 87161201
5-chloro-1,3-difluoro-2-(fluoromethyl)benzene
CID 130776716
5-chloro-1,3-difluoro-2-prop-1-en-2-ylbenzene
CID 171522333
4-chloro-2-fluoro-N'-hydroxy-6-iodobenzenecarboximidamide
CID 155888376
4-chloro-2-fluoro-6-methoxybenzoic acid
CID 53399475

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2,6-difluorobenzamide?
The IUPAC name of 4-chloro-2,6-difluorobenzamide (CID 22478130) is 4-chloro-2,6-difluorobenzamide.
What is the SMILES notation for 4-chloro-2,6-difluorobenzamide?
The canonical SMILES for 4-chloro-2,6-difluorobenzamide is NC(=O)c1c(F)cc(Cl)cc1F.
What is the InChIKey of 4-chloro-2,6-difluorobenzamide?
The InChIKey is WYCJKDFBALNGMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4ClF2NO/c8-3-1-4(9)6(7(11)12)5(10)2-3/h1-2H,(H2,11,12).
What are the key properties of 4-chloro-2,6-difluorobenzamide?
4-chloro-2,6-difluorobenzamide has a molecular weight of 191.56 g/mol, XLogP of 1.72, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2,6-difluorobenzamide is sourced from PubChem (CID 22478130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).