N-(2-chloro-4-methylphenyl)-2,3-difluorobenzamide

C14H10ClF2NO — CID 62650999

IUPACN-(2-chloro-4-methylphenyl)-2,3-difluorobenzamide
SMILESCc1ccc(NC(=O)c2cccc(F)c2F)c(Cl)c1
InChIInChI=1S/C14H10ClF2NO/c1-8-5-6-12(10(15)7-8)18-14(19)9-3-2-4-11(16)13(9)17/h2-7H,1H3,(H,18,19)
InChIKeyGYZBOARUSZKKDP-UHFFFAOYSA-N
MW281.69 g/mol
LogP4.18
Rot. Bonds2

About N-(2-chloro-4-methylphenyl)-2,3-difluorobenzamide

N-(2-chloro-4-methylphenyl)-2,3-difluorobenzamide (PubChem CID 62650999) has the molecular formula C14H10ClF2NO and a molecular weight of 281.69 g/mol. Its IUPAC name is N-(2-chloro-4-methylphenyl)-2,3-difluorobenzamide.

Molecular Properties

Compound NameN-(2-chloro-4-methylphenyl)-2,3-difluorobenzamide
PubChem CID62650999
Molecular FormulaC14H10ClF2NO
Molecular Weight281.69 g/mol
Exact Mass281.04
IUPAC NameN-(2-chloro-4-methylphenyl)-2,3-difluorobenzamide
SMILESCc1ccc(NC(=O)c2cccc(F)c2F)c(Cl)c1
InChIInChI=1S/C14H10ClF2NO/c1-8-5-6-12(10(15)7-8)18-14(19)9-3-2-4-11(16)13(9)17/h2-7H,1H3,(H,18,19)
InChIKeyGYZBOARUSZKKDP-UHFFFAOYSA-N
XLogP4.18
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.69
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,3-difluoro-N-(2-fluoro-4-methylphenyl)benzamide
CID 62648850
2,3-dichloro-N-(2-chloro-4-methylphenyl)benzamide
CID 7926718
N-(2-chloro-4-methylphenyl)-2-methylbenzamide
CID 2540447
N-(2-bromo-4-methylphenyl)-3-chloro-2-fluorobenzamide
CID 81004240
2-bromo-N-(2-chloro-4-methylphenyl)-6-fluorobenzamide
CID 115678082
N-(2-chloro-4-methylphenyl)-2-iodobenzamide
CID 8886012
N-(2-chloro-4-methylphenyl)-2,4-dimethylbenzamide
CID 2557643
N-(2-chloro-4-methylphenyl)-2,5-dimethylbenzamide
CID 2549224
N-(4-amino-2-chlorophenyl)-2-fluoro-5-methylbenzamide
CID 62515470
3-bromo-N-(2-chloro-5-methylphenyl)-2-fluorobenzamide
CID 106547569
N-(4-chloro-2-iodophenyl)-2,3-difluorobenzamide
CID 103766879
2-chloro-N-(2-fluorophenyl)-5-methylbenzamide
CID 122630269

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4-methylphenyl)-2,3-difluorobenzamide?
The IUPAC name of N-(2-chloro-4-methylphenyl)-2,3-difluorobenzamide (CID 62650999) is N-(2-chloro-4-methylphenyl)-2,3-difluorobenzamide.
What is the SMILES notation for N-(2-chloro-4-methylphenyl)-2,3-difluorobenzamide?
The canonical SMILES for N-(2-chloro-4-methylphenyl)-2,3-difluorobenzamide is Cc1ccc(NC(=O)c2cccc(F)c2F)c(Cl)c1.
What is the InChIKey of N-(2-chloro-4-methylphenyl)-2,3-difluorobenzamide?
The InChIKey is GYZBOARUSZKKDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClF2NO/c1-8-5-6-12(10(15)7-8)18-14(19)9-3-2-4-11(16)13(9)17/h2-7H,1H3,(H,18,19).
What are the key properties of N-(2-chloro-4-methylphenyl)-2,3-difluorobenzamide?
N-(2-chloro-4-methylphenyl)-2,3-difluorobenzamide has a molecular weight of 281.69 g/mol, XLogP of 4.18, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4-methylphenyl)-2,3-difluorobenzamide is sourced from PubChem (CID 62650999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).