N-(2-hydroxyphenyl)-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide

C19H13F3N2O2 — CID 59673564

IUPACN-(2-hydroxyphenyl)-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide
SMILESO=C(Nc1ccccc1O)c1ccc(-c2cc(C(F)(F)F)ccn2)cc1
InChIInChI=1S/C19H13F3N2O2/c20-19(21,22)14-9-10-23-16(11-14)12-5-7-13(8-6-12)18(26)24-15-3-1-2-4-17(15)25/h1-11,25H,(H,24,26)
InChIKeyNWMCVHCJRVWQME-UHFFFAOYSA-N
MW358.32 g/mol
LogP4.73
Rot. Bonds3

About N-(2-hydroxyphenyl)-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide

N-(2-hydroxyphenyl)-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide (PubChem CID 59673564) has the molecular formula C19H13F3N2O2 and a molecular weight of 358.32 g/mol. Its IUPAC name is N-(2-hydroxyphenyl)-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide.

Molecular Properties

Compound NameN-(2-hydroxyphenyl)-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide
PubChem CID59673564
Molecular FormulaC19H13F3N2O2
Molecular Weight358.32 g/mol
Exact Mass358.09
IUPAC NameN-(2-hydroxyphenyl)-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide
SMILESO=C(Nc1ccccc1O)c1ccc(-c2cc(C(F)(F)F)ccn2)cc1
InChIInChI=1S/C19H13F3N2O2/c20-19(21,22)14-9-10-23-16(11-14)12-5-7-13(8-6-12)18(26)24-15-3-1-2-4-17(15)25/h1-11,25H,(H,24,26)
InChIKeyNWMCVHCJRVWQME-UHFFFAOYSA-N
XLogP4.73
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.32
LogP ≤ 54.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

N-[2-chloro-4-(trifluoromethyl)phenyl]-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide
CID 59673432
N-benzhydryl-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide
CID 59673707
N-(2-oxo-1H-pyridin-4-yl)-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide
CID 143032463
N-(2,6-dimethylpyrimidin-4-yl)-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide
CID 59673003
N-[2-hydroxy-5-(trifluoromethyl)phenyl]pyridine-2-carboxamide
CID 162536125
2-[4-[4-(trifluoromethyl)-2-pyridinyl]phenyl]prop-2-enamide
CID 175876313
4-hydroxy-N-[4-(trifluoromethyl)-2-pyridinyl]benzamide
CID 118623339
2-[2-(2-hydroxyethyl)phenyl]-1-[4-[4-(trifluoromethyl)-2-pyridinyl]phenyl]ethanone
CID 143032649
N-(4-tert-butylcyclohexyl)-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide
CID 59672796
N-[[4-(dimethylamino)phenyl]methyl]-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide
CID 59673779
3-fluoro-N-[2-[[4-(trifluoromethyl)benzoyl]amino]phenyl]benzamide
CID 1207911
N-(2-hydroxyphenyl)-4-pyridin-3-ylbenzamide
CID 59672983

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyphenyl)-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide?
The IUPAC name of N-(2-hydroxyphenyl)-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide (CID 59673564) is N-(2-hydroxyphenyl)-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide.
What is the SMILES notation for N-(2-hydroxyphenyl)-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide?
The canonical SMILES for N-(2-hydroxyphenyl)-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide is O=C(Nc1ccccc1O)c1ccc(-c2cc(C(F)(F)F)ccn2)cc1.
What is the InChIKey of N-(2-hydroxyphenyl)-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide?
The InChIKey is NWMCVHCJRVWQME-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13F3N2O2/c20-19(21,22)14-9-10-23-16(11-14)12-5-7-13(8-6-12)18(26)24-15-3-1-2-4-17(15)25/h1-11,25H,(H,24,26).
What are the key properties of N-(2-hydroxyphenyl)-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide?
N-(2-hydroxyphenyl)-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide has a molecular weight of 358.32 g/mol, XLogP of 4.73, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyphenyl)-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide is sourced from PubChem (CID 59673564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).