2,3-dichloro-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]benzamide

C15H9Cl2F4NO — CID 10270238

IUPAC2,3-dichloro-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]benzamide
SMILESO=C(NCc1ccc(F)cc1C(F)(F)F)c1cccc(Cl)c1Cl
InChIInChI=1S/C15H9Cl2F4NO/c16-12-3-1-2-10(13(12)17)14(23)22-7-8-4-5-9(18)6-11(8)15(19,20)21/h1-6H,7H2,(H,22,23)
InChIKeyAPHJNAJTVFXGBD-UHFFFAOYSA-N
MW366.14 g/mol
LogP5.08
Rot. Bonds3

About 2,3-dichloro-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]benzamide

2,3-dichloro-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]benzamide (PubChem CID 10270238) has the molecular formula C15H9Cl2F4NO and a molecular weight of 366.14 g/mol. Its IUPAC name is 2,3-dichloro-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]benzamide.

Molecular Properties

Compound Name2,3-dichloro-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]benzamide
PubChem CID10270238
Molecular FormulaC15H9Cl2F4NO
Molecular Weight366.14 g/mol
Exact Mass365.00
IUPAC Name2,3-dichloro-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]benzamide
SMILESO=C(NCc1ccc(F)cc1C(F)(F)F)c1cccc(Cl)c1Cl
InChIInChI=1S/C15H9Cl2F4NO/c16-12-3-1-2-10(13(12)17)14(23)22-7-8-4-5-9(18)6-11(8)15(19,20)21/h1-6H,7H2,(H,22,23)
InChIKeyAPHJNAJTVFXGBD-UHFFFAOYSA-N
XLogP5.08
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.14
LogP ≤ 55.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-acetamido-2-fluoro-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]benzamide
CID 60567845
3-(2-chloro-6-fluorophenyl)-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-5-methyl-1,2-oxazole-4-carboxamide
CID 46474617
N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-2-hydroxy-5-methylbenzamide
CID 46474447
3-bromo-2-chloro-N-[(2,4-difluorophenyl)methyl]benzamide
CID 103985523
2,3-dichloro-N-[(2,5-dimethylphenyl)methyl]benzamide
CID 23019861
2,3-dichloro-N-[4-chloro-2-(trifluoromethyl)phenyl]benzamide
CID 2296110
3-(4-chlorophenyl)-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]propanamide
CID 46485685
2-(2,6-dimethylphenoxy)-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]acetamide
CID 55705908
2,3-dichloro-N-[[3-[(4-fluorobenzoyl)amino]phenyl]methyl]benzamide
CID 55893391
2,3-dichloro-N-[(3-chlorophenyl)methyl]benzamide
CID 17071308
N-[(2-benzylphenyl)methyl]-2,3-dichlorobenzamide
CID 23019985
N-[(3-amino-2-methylphenyl)methyl]-2,3-dichlorobenzamide
CID 103110309

Frequently Asked Questions

What is the IUPAC name of 2,3-dichloro-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]benzamide?
The IUPAC name of 2,3-dichloro-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]benzamide (CID 10270238) is 2,3-dichloro-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]benzamide.
What is the SMILES notation for 2,3-dichloro-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]benzamide?
The canonical SMILES for 2,3-dichloro-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]benzamide is O=C(NCc1ccc(F)cc1C(F)(F)F)c1cccc(Cl)c1Cl.
What is the InChIKey of 2,3-dichloro-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]benzamide?
The InChIKey is APHJNAJTVFXGBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9Cl2F4NO/c16-12-3-1-2-10(13(12)17)14(23)22-7-8-4-5-9(18)6-11(8)15(19,20)21/h1-6H,7H2,(H,22,23).
What are the key properties of 2,3-dichloro-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]benzamide?
2,3-dichloro-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]benzamide has a molecular weight of 366.14 g/mol, XLogP of 5.08, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dichloro-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]benzamide is sourced from PubChem (CID 10270238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).