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

C14H11ClFNO — CID 122630273

IUPAC4-chloro-N-(4-fluorophenyl)-3-methylbenzamide
SMILESCc1cc(C(=O)Nc2ccc(F)cc2)ccc1Cl
InChIInChI=1S/C14H11ClFNO/c1-9-8-10(2-7-13(9)15)14(18)17-12-5-3-11(16)4-6-12/h2-8H,1H3,(H,17,18)
InChIKeyBFNFPMSESXAMCB-UHFFFAOYSA-N
MW263.70 g/mol
LogP4.04
Rot. Bonds2

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

4-chloro-N-(4-fluorophenyl)-3-methylbenzamide (PubChem CID 122630273) has the molecular formula C14H11ClFNO and a molecular weight of 263.70 g/mol. Its IUPAC name is 4-chloro-N-(4-fluorophenyl)-3-methylbenzamide.

Molecular Properties

Compound Name4-chloro-N-(4-fluorophenyl)-3-methylbenzamide
PubChem CID122630273
Molecular FormulaC14H11ClFNO
Molecular Weight263.70 g/mol
Exact Mass263.05
IUPAC Name4-chloro-N-(4-fluorophenyl)-3-methylbenzamide
SMILESCc1cc(C(=O)Nc2ccc(F)cc2)ccc1Cl
InChIInChI=1S/C14H11ClFNO/c1-9-8-10(2-7-13(9)15)14(18)17-12-5-3-11(16)4-6-12/h2-8H,1H3,(H,17,18)
InChIKeyBFNFPMSESXAMCB-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

N-(3-amino-4-fluorophenyl)-4-chloro-3-methylbenzamide
CID 115736624
N-(2-bromo-5-fluorophenyl)-4-chloro-3-methylbenzamide
CID 113256553
4-N-(4-chloro-2-methylphenyl)-1-N-(4-fluorophenyl)benzene-1,4-dicarboxamide
CID 109049900
3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-N-(4-fluorophenyl)benzamide
CID 26158805
4-N-(3,5-dimethylphenyl)-1-N-(4-fluorophenyl)benzene-1,4-dicarboxamide
CID 109049661
N-(4-fluorophenyl)-4-methyl-3-sulfamoylbenzamide
CID 9070427
N-(3-chloro-4-fluorophenyl)-4-fluoro-3-methylbenzamide;formaldehyde
CID 144890602
2-[5-[(4-chloro-3-methylbenzoyl)amino]-2-pyridinyl]acetic acid
CID 107339418
4-[(3-chloro-4-methylbenzoyl)amino]benzoic acid
CID 28914625
N-(4-fluorophenyl)-3-(methanesulfonamido)-4-methylbenzamide
CID 19062500
3,4-dichloro-N-(3,4-dimethylphenyl)benzamide
CID 677956
1-N-(4-acetylphenyl)-4-N-(4-fluorophenyl)benzene-1,4-dicarboxamide
CID 109049917

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(4-fluorophenyl)-3-methylbenzamide?
The IUPAC name of 4-chloro-N-(4-fluorophenyl)-3-methylbenzamide (CID 122630273) is 4-chloro-N-(4-fluorophenyl)-3-methylbenzamide.
What is the SMILES notation for 4-chloro-N-(4-fluorophenyl)-3-methylbenzamide?
The canonical SMILES for 4-chloro-N-(4-fluorophenyl)-3-methylbenzamide is Cc1cc(C(=O)Nc2ccc(F)cc2)ccc1Cl.
What is the InChIKey of 4-chloro-N-(4-fluorophenyl)-3-methylbenzamide?
The InChIKey is BFNFPMSESXAMCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClFNO/c1-9-8-10(2-7-13(9)15)14(18)17-12-5-3-11(16)4-6-12/h2-8H,1H3,(H,17,18).
What are the key properties of 4-chloro-N-(4-fluorophenyl)-3-methylbenzamide?
4-chloro-N-(4-fluorophenyl)-3-methylbenzamide 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 4-chloro-N-(4-fluorophenyl)-3-methylbenzamide is sourced from PubChem (CID 122630273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).