2,5-dichloro-N-[3-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide

C15H9Cl2F3N2O2 — CID 108933296

IUPAC2,5-dichloro-N-[3-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide
SMILESO=C(Nc1cccc(NC(=O)C(F)(F)F)c1)c1cc(Cl)ccc1Cl
InChIInChI=1S/C15H9Cl2F3N2O2/c16-8-4-5-12(17)11(6-8)13(23)21-9-2-1-3-10(7-9)22-14(24)15(18,19)20/h1-7H,(H,21,23)(H,22,24)
InChIKeyIICHHQJACQLFLO-UHFFFAOYSA-N
MW377.15 g/mol
LogP4.75
Rot. Bonds3

About 2,5-dichloro-N-[3-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide

2,5-dichloro-N-[3-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide (PubChem CID 108933296) has the molecular formula C15H9Cl2F3N2O2 and a molecular weight of 377.15 g/mol. Its IUPAC name is 2,5-dichloro-N-[3-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide.

Molecular Properties

Compound Name2,5-dichloro-N-[3-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide
PubChem CID108933296
Molecular FormulaC15H9Cl2F3N2O2
Molecular Weight377.15 g/mol
Exact Mass376.00
IUPAC Name2,5-dichloro-N-[3-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide
SMILESO=C(Nc1cccc(NC(=O)C(F)(F)F)c1)c1cc(Cl)ccc1Cl
InChIInChI=1S/C15H9Cl2F3N2O2/c16-8-4-5-12(17)11(6-8)13(23)21-9-2-1-3-10(7-9)22-14(24)15(18,19)20/h1-7H,(H,21,23)(H,22,24)
InChIKeyIICHHQJACQLFLO-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

2,4-dichloro-N-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide
CID 9203694
2,5-dichloro-N-(3-chloro-4-fluorophenyl)benzamide
CID 690469
N-[3-(bromomethyl)phenyl]-2,5-dichlorobenzamide
CID 114307198
2,4-dichloro-N-[1-[3-[(2,2,2-trifluoroacetyl)amino]phenyl]ethylideneamino]benzamide
CID 3699366
2,5-dichloro-N-[3-(1-hydroxyethyl)phenyl]benzamide
CID 91676947
N-(3-acetamidophenyl)-2,2,2-trifluoroacetamide
CID 895724
2,5-dichloro-N-(4-chloro-3-hydroxyphenyl)benzamide
CID 64789245
2-methoxy-N-[3-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide
CID 108933228
(E)-3-[3-[(2,5-dichlorobenzoyl)amino]phenyl]prop-2-enoic acid
CID 91682890
4-chloro-2-fluoro-N-[3-(trifluoromethyl)phenyl]benzamide
CID 26274156
N-[3-(2-aminoethoxy)phenyl]-2,5-dichlorobenzamide
CID 63121176
N-(3-chlorophenyl)-2-fluorobenzamide
CID 531935

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N-[3-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide?
The IUPAC name of 2,5-dichloro-N-[3-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide (CID 108933296) is 2,5-dichloro-N-[3-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide.
What is the SMILES notation for 2,5-dichloro-N-[3-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide?
The canonical SMILES for 2,5-dichloro-N-[3-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide is O=C(Nc1cccc(NC(=O)C(F)(F)F)c1)c1cc(Cl)ccc1Cl.
What is the InChIKey of 2,5-dichloro-N-[3-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide?
The InChIKey is IICHHQJACQLFLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9Cl2F3N2O2/c16-8-4-5-12(17)11(6-8)13(23)21-9-2-1-3-10(7-9)22-14(24)15(18,19)20/h1-7H,(H,21,23)(H,22,24).
What are the key properties of 2,5-dichloro-N-[3-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide?
2,5-dichloro-N-[3-[(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 2,5-dichloro-N-[3-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide is sourced from PubChem (CID 108933296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).