4-chloro-N-(3-chlorophenyl)-3-(trifluoromethyl)benzamide

C14H8Cl2F3NO — CID 154268338

IUPAC4-chloro-N-(3-chlorophenyl)-3-(trifluoromethyl)benzamide
SMILESO=C(Nc1cccc(Cl)c1)c1ccc(Cl)c(C(F)(F)F)c1
InChIInChI=1S/C14H8Cl2F3NO/c15-9-2-1-3-10(7-9)20-13(21)8-4-5-12(16)11(6-8)14(17,18)19/h1-7H,(H,20,21)
InChIKeyXYKJCECYTMWDRI-UHFFFAOYSA-N
MW334.12 g/mol
LogP5.26
Rot. Bonds2

About 4-chloro-N-(3-chlorophenyl)-3-(trifluoromethyl)benzamide

4-chloro-N-(3-chlorophenyl)-3-(trifluoromethyl)benzamide (PubChem CID 154268338) has the molecular formula C14H8Cl2F3NO and a molecular weight of 334.12 g/mol. Its IUPAC name is 4-chloro-N-(3-chlorophenyl)-3-(trifluoromethyl)benzamide.

Molecular Properties

Compound Name4-chloro-N-(3-chlorophenyl)-3-(trifluoromethyl)benzamide
PubChem CID154268338
Molecular FormulaC14H8Cl2F3NO
Molecular Weight334.12 g/mol
Exact Mass332.99
IUPAC Name4-chloro-N-(3-chlorophenyl)-3-(trifluoromethyl)benzamide
SMILESO=C(Nc1cccc(Cl)c1)c1ccc(Cl)c(C(F)(F)F)c1
InChIInChI=1S/C14H8Cl2F3NO/c15-9-2-1-3-10(7-9)20-13(21)8-4-5-12(16)11(6-8)14(17,18)19/h1-7H,(H,20,21)
InChIKeyXYKJCECYTMWDRI-UHFFFAOYSA-N
XLogP5.26
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.12
LogP ≤ 55.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[4-bromo-3-(trifluoromethyl)phenyl]-3-chlorobenzamide
CID 7920374
N-[4-chloro-3-(trifluoromethyl)phenyl]-4-iodobenzamide
CID 1221652
4-chloro-N-(4-ethylphenyl)-3-(trifluoromethyl)benzamide
CID 143174015
3-chloro-N-[3-[(3-chlorobenzoyl)amino]phenyl]benzamide
CID 1369981
5-[2-[3-[[4-chloro-3-(trifluoromethyl)benzoyl]amino]phenyl]ethynyl]pyridine-3-carboxamide
CID 144862877
N-[4-chloro-3-(trifluoromethyl)phenyl]-3,5-difluorobenzamide
CID 2084506
3-chloro-N-[4-chloro-3-(trifluoromethyl)phenyl]-4-methoxybenzamide
CID 44871489
N-[4-chloro-3-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 100703046
3-N-(3-chlorophenyl)benzene-1,3-dicarboxamide
CID 35554073
4-chloro-N-[4-chloro-3-(trifluoromethyl)phenyl]-3-[(3-methylphenyl)sulfamoyl]benzamide
CID 126415021
N-[4-chloro-3-(trifluoromethyl)phenyl]quinoline-7-carboxamide
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CID 61295455

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(3-chlorophenyl)-3-(trifluoromethyl)benzamide?
The IUPAC name of 4-chloro-N-(3-chlorophenyl)-3-(trifluoromethyl)benzamide (CID 154268338) is 4-chloro-N-(3-chlorophenyl)-3-(trifluoromethyl)benzamide.
What is the SMILES notation for 4-chloro-N-(3-chlorophenyl)-3-(trifluoromethyl)benzamide?
The canonical SMILES for 4-chloro-N-(3-chlorophenyl)-3-(trifluoromethyl)benzamide is O=C(Nc1cccc(Cl)c1)c1ccc(Cl)c(C(F)(F)F)c1.
What is the InChIKey of 4-chloro-N-(3-chlorophenyl)-3-(trifluoromethyl)benzamide?
The InChIKey is XYKJCECYTMWDRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8Cl2F3NO/c15-9-2-1-3-10(7-9)20-13(21)8-4-5-12(16)11(6-8)14(17,18)19/h1-7H,(H,20,21).
What are the key properties of 4-chloro-N-(3-chlorophenyl)-3-(trifluoromethyl)benzamide?
4-chloro-N-(3-chlorophenyl)-3-(trifluoromethyl)benzamide has a molecular weight of 334.12 g/mol, XLogP of 5.26, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(3-chlorophenyl)-3-(trifluoromethyl)benzamide is sourced from PubChem (CID 154268338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).