4,5-dichloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide

C14H8Cl2F3NO2 — CID 134151897

IUPAC4,5-dichloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide
SMILESO=C(Nc1ccc(C(F)(F)F)cc1)c1cc(Cl)c(Cl)cc1O
InChIInChI=1S/C14H8Cl2F3NO2/c15-10-5-9(12(21)6-11(10)16)13(22)20-8-3-1-7(2-4-8)14(17,18)19/h1-6,21H,(H,20,22)
InChIKeyGTKGTEDQYWBEJM-UHFFFAOYSA-N
MW350.12 g/mol
LogP4.97
Rot. Bonds2

About 4,5-dichloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide

4,5-dichloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide (PubChem CID 134151897) has the molecular formula C14H8Cl2F3NO2 and a molecular weight of 350.12 g/mol. Its IUPAC name is 4,5-dichloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide.

Molecular Properties

Compound Name4,5-dichloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide
PubChem CID134151897
Molecular FormulaC14H8Cl2F3NO2
Molecular Weight350.12 g/mol
Exact Mass348.99
IUPAC Name4,5-dichloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide
SMILESO=C(Nc1ccc(C(F)(F)F)cc1)c1cc(Cl)c(Cl)cc1O
InChIInChI=1S/C14H8Cl2F3NO2/c15-10-5-9(12(21)6-11(10)16)13(22)20-8-3-1-7(2-4-8)14(17,18)19/h1-6,21H,(H,20,22)
InChIKeyGTKGTEDQYWBEJM-UHFFFAOYSA-N
XLogP4.97
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.12
LogP ≤ 54.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-4-chloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide
CID 134146320
2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide
CID 2064029
2-hydroxy-1-N,3-N-bis[4-(trifluoromethyl)phenyl]benzene-1,3-dicarboxamide
CID 155920070
3-acetyl-4-chloro-N-[4-(trifluoromethyl)phenyl]benzamide
CID 147118620
2,5-dimethyl-N-[4-(trifluoromethyl)phenyl]benzamide
CID 7777818
5-chloro-4-fluoro-2-hydroxy-N-[4-(trifluoromethylsulfanyl)phenyl]benzamide
CID 166523086
2-chloro-4-nitro-N-[4-(trifluoromethyl)phenyl]benzamide
CID 2988054
5-chloro-2-nitro-N-[4-(trifluoromethyl)phenyl]benzamide
CID 2684275
2-chloro-5-fluoro-N-[4-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 87757105
ethane;2-hydroxy-5-propyl-N-[4-(trifluoromethyl)phenyl]benzamide
CID 163370448
4-bromo-3-chloro-N-[4-(trifluoromethyl)phenyl]benzamide
CID 81295641
5-acetamido-N-[3,5-bis(trifluoromethyl)phenyl]-2-hydroxybenzamide
CID 71554885

Frequently Asked Questions

What is the IUPAC name of 4,5-dichloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide?
The IUPAC name of 4,5-dichloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide (CID 134151897) is 4,5-dichloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide.
What is the SMILES notation for 4,5-dichloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide?
The canonical SMILES for 4,5-dichloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide is O=C(Nc1ccc(C(F)(F)F)cc1)c1cc(Cl)c(Cl)cc1O.
What is the InChIKey of 4,5-dichloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide?
The InChIKey is GTKGTEDQYWBEJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8Cl2F3NO2/c15-10-5-9(12(21)6-11(10)16)13(22)20-8-3-1-7(2-4-8)14(17,18)19/h1-6,21H,(H,20,22).
What are the key properties of 4,5-dichloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide?
4,5-dichloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide has a molecular weight of 350.12 g/mol, XLogP of 4.97, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dichloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide is sourced from PubChem (CID 134151897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).