N-(3-chloro-4-fluorophenyl)-2-fluoro-3-methylbenzamide

C14H10ClF2NO — CID 80719146

IUPACN-(3-chloro-4-fluorophenyl)-2-fluoro-3-methylbenzamide
SMILESCc1cccc(C(=O)Nc2ccc(F)c(Cl)c2)c1F
InChIInChI=1S/C14H10ClF2NO/c1-8-3-2-4-10(13(8)17)14(19)18-9-5-6-12(16)11(15)7-9/h2-7H,1H3,(H,18,19)
InChIKeyFMIDZJHGXVNQNC-UHFFFAOYSA-N
MW281.69 g/mol
LogP4.18
Rot. Bonds2

About N-(3-chloro-4-fluorophenyl)-2-fluoro-3-methylbenzamide

N-(3-chloro-4-fluorophenyl)-2-fluoro-3-methylbenzamide (PubChem CID 80719146) has the molecular formula C14H10ClF2NO and a molecular weight of 281.69 g/mol. Its IUPAC name is N-(3-chloro-4-fluorophenyl)-2-fluoro-3-methylbenzamide.

Molecular Properties

Compound NameN-(3-chloro-4-fluorophenyl)-2-fluoro-3-methylbenzamide
PubChem CID80719146
Molecular FormulaC14H10ClF2NO
Molecular Weight281.69 g/mol
Exact Mass281.04
IUPAC NameN-(3-chloro-4-fluorophenyl)-2-fluoro-3-methylbenzamide
SMILESCc1cccc(C(=O)Nc2ccc(F)c(Cl)c2)c1F
InChIInChI=1S/C14H10ClF2NO/c1-8-3-2-4-10(13(8)17)14(19)18-9-5-6-12(16)11(15)7-9/h2-7H,1H3,(H,18,19)
InChIKeyFMIDZJHGXVNQNC-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

N-(4-amino-3-chlorophenyl)-2-fluoro-3-methylbenzamide
CID 82861951
N-(3,5-dichloro-4-hydroxyphenyl)-2-fluoro-3-methylbenzamide
CID 82884561
2-fluoro-N-(3-fluoro-4-methylphenyl)-3-methylbenzamide
CID 80718596
N-(4-chloro-3-methoxyphenyl)-2-fluoro-3-methylbenzamide
CID 107271805
N-(3-chloro-4-fluorophenyl)-2-fluoro-3-sulfamoylbenzamide
CID 121267983
N-[4-chloro-3-(ethylcarbamoyl)phenyl]-2-fluoro-3-methylbenzamide
CID 131939887
N-(3-chloro-4-fluorophenyl)-2,4-dimethylbenzamide
CID 969420
N-(2,5-dichlorophenyl)-2-fluoro-3-methylbenzamide
CID 80717854
N-(3-chloro-4-fluorophenyl)-2-fluoro-5-methylbenzamide
CID 62510400
3-amino-2-chloro-N-(3-chloro-4-fluorophenyl)benzamide
CID 112574586
2,5-dichloro-N-(3-chloro-4-fluorophenyl)benzamide
CID 690469
N-(3-chloro-4-fluorophenyl)-2-iodobenzamide
CID 615783

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-fluorophenyl)-2-fluoro-3-methylbenzamide?
The IUPAC name of N-(3-chloro-4-fluorophenyl)-2-fluoro-3-methylbenzamide (CID 80719146) is N-(3-chloro-4-fluorophenyl)-2-fluoro-3-methylbenzamide.
What is the SMILES notation for N-(3-chloro-4-fluorophenyl)-2-fluoro-3-methylbenzamide?
The canonical SMILES for N-(3-chloro-4-fluorophenyl)-2-fluoro-3-methylbenzamide is Cc1cccc(C(=O)Nc2ccc(F)c(Cl)c2)c1F.
What is the InChIKey of N-(3-chloro-4-fluorophenyl)-2-fluoro-3-methylbenzamide?
The InChIKey is FMIDZJHGXVNQNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClF2NO/c1-8-3-2-4-10(13(8)17)14(19)18-9-5-6-12(16)11(15)7-9/h2-7H,1H3,(H,18,19).
What are the key properties of N-(3-chloro-4-fluorophenyl)-2-fluoro-3-methylbenzamide?
N-(3-chloro-4-fluorophenyl)-2-fluoro-3-methylbenzamide 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-(3-chloro-4-fluorophenyl)-2-fluoro-3-methylbenzamide is sourced from PubChem (CID 80719146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).