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

C14H10ClF2NO — CID 103733508

IUPACN-(2-chloro-5-fluorophenyl)-2-fluoro-4-methylbenzamide
SMILESCc1ccc(C(=O)Nc2cc(F)ccc2Cl)c(F)c1
InChIInChI=1S/C14H10ClF2NO/c1-8-2-4-10(12(17)6-8)14(19)18-13-7-9(16)3-5-11(13)15/h2-7H,1H3,(H,18,19)
InChIKeyQSMRIPCQAJHVCU-UHFFFAOYSA-N
MW281.69 g/mol
LogP4.18
Rot. Bonds2

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

N-(2-chloro-5-fluorophenyl)-2-fluoro-4-methylbenzamide (PubChem CID 103733508) has the molecular formula C14H10ClF2NO and a molecular weight of 281.69 g/mol. Its IUPAC name is N-(2-chloro-5-fluorophenyl)-2-fluoro-4-methylbenzamide.

Molecular Properties

Compound NameN-(2-chloro-5-fluorophenyl)-2-fluoro-4-methylbenzamide
PubChem CID103733508
Molecular FormulaC14H10ClF2NO
Molecular Weight281.69 g/mol
Exact Mass281.04
IUPAC NameN-(2-chloro-5-fluorophenyl)-2-fluoro-4-methylbenzamide
SMILESCc1ccc(C(=O)Nc2cc(F)ccc2Cl)c(F)c1
InChIInChI=1S/C14H10ClF2NO/c1-8-2-4-10(12(17)6-8)14(19)18-13-7-9(16)3-5-11(13)15/h2-7H,1H3,(H,18,19)
InChIKeyQSMRIPCQAJHVCU-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-(2-chloro-5-fluorophenyl)-2-hydrazinyl-5-methylbenzamide
CID 107531322
4-bromo-N-(2-chloro-5-methylphenyl)-2-fluorobenzamide
CID 103769423
N-(2-chloro-5-fluorophenyl)-2-(ethylamino)-5-methylbenzamide
CID 107531156
N-(2-chloro-5-fluorophenyl)-2-fluorobenzamide
CID 113231148
N-(5-chloro-2-fluorophenyl)-2-fluoro-4-methylbenzamide
CID 79770803
N-(2-amino-4-methylphenyl)-2-chloro-4-fluorobenzamide
CID 43259104
N-[2-chloro-5-hydroxy-4-[(4-methylbenzoyl)amino]phenyl]-2,4-difluorobenzamide
CID 23562051
N-(2-bromo-5-methylphenyl)-2,4-difluorobenzamide
CID 82706445
N-(2-carbamothioyl-4-fluorophenyl)-2-fluoro-4-methylbenzamide
CID 82683459
N-(4-amino-5-chloro-2-methylphenyl)-2-fluoro-4-methylbenzamide
CID 104667653
2-chloro-N-(2-fluorophenyl)-5-methylbenzamide
CID 122630269
N-(2-chloro-4-fluorophenyl)-5-methyl-2-(methylamino)benzamide
CID 62511235

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-5-fluorophenyl)-2-fluoro-4-methylbenzamide?
The IUPAC name of N-(2-chloro-5-fluorophenyl)-2-fluoro-4-methylbenzamide (CID 103733508) is N-(2-chloro-5-fluorophenyl)-2-fluoro-4-methylbenzamide.
What is the SMILES notation for N-(2-chloro-5-fluorophenyl)-2-fluoro-4-methylbenzamide?
The canonical SMILES for N-(2-chloro-5-fluorophenyl)-2-fluoro-4-methylbenzamide is Cc1ccc(C(=O)Nc2cc(F)ccc2Cl)c(F)c1.
What is the InChIKey of N-(2-chloro-5-fluorophenyl)-2-fluoro-4-methylbenzamide?
The InChIKey is QSMRIPCQAJHVCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClF2NO/c1-8-2-4-10(12(17)6-8)14(19)18-13-7-9(16)3-5-11(13)15/h2-7H,1H3,(H,18,19).
What are the key properties of N-(2-chloro-5-fluorophenyl)-2-fluoro-4-methylbenzamide?
N-(2-chloro-5-fluorophenyl)-2-fluoro-4-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-(2-chloro-5-fluorophenyl)-2-fluoro-4-methylbenzamide is sourced from PubChem (CID 103733508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).