2,4-dichloro-N-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide

C15H9Cl2F3N2O2 — CID 9203694

IUPAC2,4-dichloro-N-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide
SMILESO=C(Nc1ccc(NC(=O)C(F)(F)F)cc1)c1ccc(Cl)cc1Cl
InChIInChI=1S/C15H9Cl2F3N2O2/c16-8-1-6-11(12(17)7-8)13(23)21-9-2-4-10(5-3-9)22-14(24)15(18,19)20/h1-7H,(H,21,23)(H,22,24)
InChIKeyFGACLPVVPMLGFG-UHFFFAOYSA-N
MW377.15 g/mol
LogP4.75
Rot. Bonds3

About 2,4-dichloro-N-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide

2,4-dichloro-N-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide (PubChem CID 9203694) has the molecular formula C15H9Cl2F3N2O2 and a molecular weight of 377.15 g/mol. Its IUPAC name is 2,4-dichloro-N-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide.

Molecular Properties

Compound Name2,4-dichloro-N-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide
PubChem CID9203694
Molecular FormulaC15H9Cl2F3N2O2
Molecular Weight377.15 g/mol
Exact Mass376.00
IUPAC Name2,4-dichloro-N-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide
SMILESO=C(Nc1ccc(NC(=O)C(F)(F)F)cc1)c1ccc(Cl)cc1Cl
InChIInChI=1S/C15H9Cl2F3N2O2/c16-8-1-6-11(12(17)7-8)13(23)21-9-2-4-10(5-3-9)22-14(24)15(18,19)20/h1-7H,(H,21,23)(H,22,24)
InChIKeyFGACLPVVPMLGFG-UHFFFAOYSA-N
XLogP4.75
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.15
LogP ≤ 54.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-acetamidophenyl)-2,4-dichlorobenzamide
CID 786004
2,4-dichloro-N-(4-sulfanylphenyl)benzamide
CID 143459356
2,5-dichloro-N-[3-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide
CID 108933296
2,4-dichloro-N-[1-[3-[(2,2,2-trifluoroacetyl)amino]phenyl]ethylideneamino]benzamide
CID 3699366
2,4-dichloro-N-[4-[4-(2,2,2-trifluoroacetyl)piperazin-1-yl]phenyl]benzamide
CID 17050371
2,4-dichloro-N-[4-[[2-(4-chlorophenyl)acetyl]amino]phenyl]benzamide
CID 1348326
2,4-dichloro-N-[4-[(3,5-dimethylbenzoyl)amino]phenyl]benzamide
CID 2206480
2,2,2-trifluoro-N-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]acetamide
CID 5013683
2,4-dichloro-N-(4-isocyanatophenyl)benzamide
CID 169353449
2,4-dichloro-N-[4-[(2,4-dichlorobenzoyl)sulfamoyl]phenyl]benzamide
CID 5064055
N-[4-(1-aminoethyl)phenyl]-2,4-dichlorobenzamide
CID 43321115
methyl 2-chloro-4-[(2,2,2-trifluoroacetyl)amino]benzoate
CID 118454929

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-N-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide?
The IUPAC name of 2,4-dichloro-N-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide (CID 9203694) is 2,4-dichloro-N-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide.
What is the SMILES notation for 2,4-dichloro-N-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide?
The canonical SMILES for 2,4-dichloro-N-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide is O=C(Nc1ccc(NC(=O)C(F)(F)F)cc1)c1ccc(Cl)cc1Cl.
What is the InChIKey of 2,4-dichloro-N-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide?
The InChIKey is FGACLPVVPMLGFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9Cl2F3N2O2/c16-8-1-6-11(12(17)7-8)13(23)21-9-2-4-10(5-3-9)22-14(24)15(18,19)20/h1-7H,(H,21,23)(H,22,24).
What are the key properties of 2,4-dichloro-N-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide?
2,4-dichloro-N-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide has a molecular weight of 377.15 g/mol, XLogP of 4.75, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-N-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide is sourced from PubChem (CID 9203694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).