N-(4-chloro-2-fluorophenyl)-2-fluoro-5-methylbenzamide

C14H10ClF2NO — CID 55083427

IUPACN-(4-chloro-2-fluorophenyl)-2-fluoro-5-methylbenzamide
SMILESCc1ccc(F)c(C(=O)Nc2ccc(Cl)cc2F)c1
InChIInChI=1S/C14H10ClF2NO/c1-8-2-4-11(16)10(6-8)14(19)18-13-5-3-9(15)7-12(13)17/h2-7H,1H3,(H,18,19)
InChIKeySKKBBHZAMGRLOJ-UHFFFAOYSA-N
MW281.69 g/mol
LogP4.18
Rot. Bonds2

About N-(4-chloro-2-fluorophenyl)-2-fluoro-5-methylbenzamide

N-(4-chloro-2-fluorophenyl)-2-fluoro-5-methylbenzamide (PubChem CID 55083427) has the molecular formula C14H10ClF2NO and a molecular weight of 281.69 g/mol. Its IUPAC name is N-(4-chloro-2-fluorophenyl)-2-fluoro-5-methylbenzamide.

Molecular Properties

Compound NameN-(4-chloro-2-fluorophenyl)-2-fluoro-5-methylbenzamide
PubChem CID55083427
Molecular FormulaC14H10ClF2NO
Molecular Weight281.69 g/mol
Exact Mass281.04
IUPAC NameN-(4-chloro-2-fluorophenyl)-2-fluoro-5-methylbenzamide
SMILESCc1ccc(F)c(C(=O)Nc2ccc(Cl)cc2F)c1
InChIInChI=1S/C14H10ClF2NO/c1-8-2-4-11(16)10(6-8)14(19)18-13-5-3-9(15)7-12(13)17/h2-7H,1H3,(H,18,19)
InChIKeySKKBBHZAMGRLOJ-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-bromo-N-(4-chloro-2-fluorophenyl)-5-methylbenzamide
CID 80948575
4-chloro-2-[(2-fluoro-5-methylbenzoyl)amino]benzoic acid
CID 62516513
N-(4-amino-2-chlorophenyl)-2-fluoro-5-methylbenzamide
CID 62515470
2-[(2-fluoro-5-methylbenzoyl)amino]-5-methylbenzoic acid
CID 62515827
N-(2-chlorophenyl)-2-fluoro-5-methylbenzamide
CID 62509353
N-(5-chloro-2-fluorophenyl)-2-fluoro-4-methylbenzamide
CID 79770803
2-[(2-fluoro-5-methylbenzoyl)amino]-5-hydroxybenzoic acid
CID 62514253
N-(2-fluoro-4-methylphenyl)-2-hydroxy-4-methylbenzamide
CID 28881726
2-fluoro-N-(4-iodo-2-methylphenyl)-5-methylbenzamide
CID 55083380
N-(4-chloro-2-fluorophenyl)-2,4,6-trimethylbenzamide
CID 6469057
2,3-difluoro-N-(2-fluoro-4-methylphenyl)benzamide
CID 62648850
N-(2-fluoro-4-methylphenyl)-2-methyl-5-sulfanylbenzamide
CID 107021979

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-fluorophenyl)-2-fluoro-5-methylbenzamide?
The IUPAC name of N-(4-chloro-2-fluorophenyl)-2-fluoro-5-methylbenzamide (CID 55083427) is N-(4-chloro-2-fluorophenyl)-2-fluoro-5-methylbenzamide.
What is the SMILES notation for N-(4-chloro-2-fluorophenyl)-2-fluoro-5-methylbenzamide?
The canonical SMILES for N-(4-chloro-2-fluorophenyl)-2-fluoro-5-methylbenzamide is Cc1ccc(F)c(C(=O)Nc2ccc(Cl)cc2F)c1.
What is the InChIKey of N-(4-chloro-2-fluorophenyl)-2-fluoro-5-methylbenzamide?
The InChIKey is SKKBBHZAMGRLOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClF2NO/c1-8-2-4-11(16)10(6-8)14(19)18-13-5-3-9(15)7-12(13)17/h2-7H,1H3,(H,18,19).
What are the key properties of N-(4-chloro-2-fluorophenyl)-2-fluoro-5-methylbenzamide?
N-(4-chloro-2-fluorophenyl)-2-fluoro-5-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-(4-chloro-2-fluorophenyl)-2-fluoro-5-methylbenzamide is sourced from PubChem (CID 55083427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).