N-(4-chloro-2-methylphenyl)-3-fluorobenzamide

C14H11ClFNO — CID 2671206

IUPACN-(4-chloro-2-methylphenyl)-3-fluorobenzamide
SMILESCc1cc(Cl)ccc1NC(=O)c1cccc(F)c1
InChIInChI=1S/C14H11ClFNO/c1-9-7-11(15)5-6-13(9)17-14(18)10-3-2-4-12(16)8-10/h2-8H,1H3,(H,17,18)
InChIKeyDXLIAYUHZPXIGX-UHFFFAOYSA-N
MW263.70 g/mol
LogP4.04
Rot. Bonds2

About N-(4-chloro-2-methylphenyl)-3-fluorobenzamide

N-(4-chloro-2-methylphenyl)-3-fluorobenzamide (PubChem CID 2671206) has the molecular formula C14H11ClFNO and a molecular weight of 263.70 g/mol. Its IUPAC name is N-(4-chloro-2-methylphenyl)-3-fluorobenzamide.

Molecular Properties

Compound NameN-(4-chloro-2-methylphenyl)-3-fluorobenzamide
PubChem CID2671206
Molecular FormulaC14H11ClFNO
Molecular Weight263.70 g/mol
Exact Mass263.05
IUPAC NameN-(4-chloro-2-methylphenyl)-3-fluorobenzamide
SMILESCc1cc(Cl)ccc1NC(=O)c1cccc(F)c1
InChIInChI=1S/C14H11ClFNO/c1-9-7-11(15)5-6-13(9)17-14(18)10-3-2-4-12(16)8-10/h2-8H,1H3,(H,17,18)
InChIKeyDXLIAYUHZPXIGX-UHFFFAOYSA-N
XLogP4.04
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.70
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-N-(4-chloro-2-methylphenyl)-1-N-[(4-fluorophenyl)methyl]benzene-1,3-dicarboxamide
CID 109054705
3-(aminomethyl)-N-(4-chloro-2-methylphenyl)benzamide
CID 82546496
N-(4-fluoro-2-methylphenyl)-3-methylbenzamide
CID 2550656
4-N-(4-chloro-2-methylphenyl)-1-N-(4-fluorophenyl)benzene-1,4-dicarboxamide
CID 109049900
3-[(4-fluoro-2-methylphenyl)carbamoyl]benzoic acid
CID 43452888
3-fluoro-N-[4-(3-hydroxyprop-1-ynyl)-2-methylphenyl]benzamide
CID 60802449
N-[2-(3-aminopropanoylamino)-4-chlorophenyl]-3-fluorobenzamide
CID 82034776
N-(5-amino-2,4-dimethylphenyl)-3-fluorobenzamide
CID 104757128
1-N-butyl-3-N-(4-chloro-2-methylphenyl)benzene-1,3-dicarboxamide
CID 109051168
N-[5-chloro-2-[(3-fluorobenzoyl)amino]phenyl]furan-2-carboxamide
CID 55645358
N-(4-chloro-2-methylphenyl)-1-(3-fluorobenzoyl)piperidine-4-carboxamide
CID 113007278
N-(4-chloro-2-methylphenyl)-4-phenylbenzamide
CID 19174130

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-methylphenyl)-3-fluorobenzamide?
The IUPAC name of N-(4-chloro-2-methylphenyl)-3-fluorobenzamide (CID 2671206) is N-(4-chloro-2-methylphenyl)-3-fluorobenzamide.
What is the SMILES notation for N-(4-chloro-2-methylphenyl)-3-fluorobenzamide?
The canonical SMILES for N-(4-chloro-2-methylphenyl)-3-fluorobenzamide is Cc1cc(Cl)ccc1NC(=O)c1cccc(F)c1.
What is the InChIKey of N-(4-chloro-2-methylphenyl)-3-fluorobenzamide?
The InChIKey is DXLIAYUHZPXIGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClFNO/c1-9-7-11(15)5-6-13(9)17-14(18)10-3-2-4-12(16)8-10/h2-8H,1H3,(H,17,18).
What are the key properties of N-(4-chloro-2-methylphenyl)-3-fluorobenzamide?
N-(4-chloro-2-methylphenyl)-3-fluorobenzamide has a molecular weight of 263.70 g/mol, XLogP of 4.04, 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-methylphenyl)-3-fluorobenzamide is sourced from PubChem (CID 2671206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).