2-hydroxy-N-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]benzamide

C21H16F3NO3 — CID 5123507

IUPAC2-hydroxy-N-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]benzamide
SMILESO=C(Nc1cc(C(F)(F)F)ccc1OCc1ccccc1)c1ccccc1O
InChIInChI=1S/C21H16F3NO3/c22-21(23,24)15-10-11-19(28-13-14-6-2-1-3-7-14)17(12-15)25-20(27)16-8-4-5-9-18(16)26/h1-12,26H,13H2,(H,25,27)
InChIKeyYUAGXPYKUSSNCN-UHFFFAOYSA-N
MW387.36 g/mol
LogP5.24
Rot. Bonds5

About 2-hydroxy-N-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]benzamide

2-hydroxy-N-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]benzamide (PubChem CID 5123507) has the molecular formula C21H16F3NO3 and a molecular weight of 387.36 g/mol. Its IUPAC name is 2-hydroxy-N-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]benzamide.

Molecular Properties

Compound Name2-hydroxy-N-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]benzamide
PubChem CID5123507
Molecular FormulaC21H16F3NO3
Molecular Weight387.36 g/mol
Exact Mass387.11
IUPAC Name2-hydroxy-N-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]benzamide
SMILESO=C(Nc1cc(C(F)(F)F)ccc1OCc1ccccc1)c1ccccc1O
InChIInChI=1S/C21H16F3NO3/c22-21(23,24)15-10-11-19(28-13-14-6-2-1-3-7-14)17(12-15)25-20(27)16-8-4-5-9-18(16)26/h1-12,26H,13H2,(H,25,27)
InChIKeyYUAGXPYKUSSNCN-UHFFFAOYSA-N
XLogP5.24
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.36
LogP ≤ 55.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]benzamide?
The IUPAC name of 2-hydroxy-N-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]benzamide (CID 5123507) is 2-hydroxy-N-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]benzamide.
What is the SMILES notation for 2-hydroxy-N-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]benzamide?
The canonical SMILES for 2-hydroxy-N-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]benzamide is O=C(Nc1cc(C(F)(F)F)ccc1OCc1ccccc1)c1ccccc1O.
What is the InChIKey of 2-hydroxy-N-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]benzamide?
The InChIKey is YUAGXPYKUSSNCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16F3NO3/c22-21(23,24)15-10-11-19(28-13-14-6-2-1-3-7-14)17(12-15)25-20(27)16-8-4-5-9-18(16)26/h1-12,26H,13H2,(H,25,27).
What are the key properties of 2-hydroxy-N-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]benzamide?
2-hydroxy-N-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]benzamide has a molecular weight of 387.36 g/mol, XLogP of 5.24, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]benzamide is sourced from PubChem (CID 5123507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).