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

C13H9F3N2O2 — CID 118623339

IUPAC4-hydroxy-N-[4-(trifluoromethyl)-2-pyridinyl]benzamide
SMILESO=C(Nc1cc(C(F)(F)F)ccn1)c1ccc(O)cc1
InChIInChI=1S/C13H9F3N2O2/c14-13(15,16)9-5-6-17-11(7-9)18-12(20)8-1-3-10(19)4-2-8/h1-7,19H,(H,17,18,20)
InChIKeyQSMPEOJFIWRDLR-UHFFFAOYSA-N
MW282.22 g/mol
LogP3.06
Rot. Bonds2

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

4-hydroxy-N-[4-(trifluoromethyl)-2-pyridinyl]benzamide (PubChem CID 118623339) has the molecular formula C13H9F3N2O2 and a molecular weight of 282.22 g/mol. Its IUPAC name is 4-hydroxy-N-[4-(trifluoromethyl)-2-pyridinyl]benzamide.

Molecular Properties

Compound Name4-hydroxy-N-[4-(trifluoromethyl)-2-pyridinyl]benzamide
PubChem CID118623339
Molecular FormulaC13H9F3N2O2
Molecular Weight282.22 g/mol
Exact Mass282.06
IUPAC Name4-hydroxy-N-[4-(trifluoromethyl)-2-pyridinyl]benzamide
SMILESO=C(Nc1cc(C(F)(F)F)ccn1)c1ccc(O)cc1
InChIInChI=1S/C13H9F3N2O2/c14-13(15,16)9-5-6-17-11(7-9)18-12(20)8-1-3-10(19)4-2-8/h1-7,19H,(H,17,18,20)
InChIKeyQSMPEOJFIWRDLR-UHFFFAOYSA-N
XLogP3.06
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.22
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,4-dimethyl-N-[4-(trifluoromethyl)-2-pyridinyl]benzamide
CID 70790724
3-N-[4-(trifluoromethyl)-2-pyridinyl]benzene-1,3-dicarboxamide
CID 90303181
[4-(trifluoromethyl)-2-pyridinyl]carbamic acid
CID 67479537
4-bromo-3-(1,1-difluoroethyl)-N-[4-(trifluoromethyl)-2-pyridinyl]benzamide
CID 86727855
2-methyl-N-[4-(trifluoromethyl)-2-pyridinyl]pyrazole-3-carboxamide
CID 99819963
4-hydroxy-N-(4-methoxy-2-pyridinyl)benzamide
CID 121273557
4-[(Z)-amino-(3-amino-1H-pyrazin-2-ylidene)methyl]-N-[4-(trifluoromethyl)-2-pyridinyl]benzamide
CID 90316437
2-methyl-N-[4-(trifluoromethyl)-2-pyridinyl]benzamide
CID 141350962
N-(4-chloro-2-pyridinyl)-3-(trifluoromethyl)benzamide
CID 115626766
2,2,3,3,4,4-hexafluoro-N-[4-(trifluoromethyl)-2-pyridinyl]pentanamide
CID 170315431
3-(trifluoromethyl)-N'-[4-(trifluoromethyl)-2-pyridinyl]benzohydrazide
CID 599454
3-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-N-[4-(trifluoromethyl)-2-pyridinyl]benzamide
CID 71226188

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-[4-(trifluoromethyl)-2-pyridinyl]benzamide?
The IUPAC name of 4-hydroxy-N-[4-(trifluoromethyl)-2-pyridinyl]benzamide (CID 118623339) is 4-hydroxy-N-[4-(trifluoromethyl)-2-pyridinyl]benzamide.
What is the SMILES notation for 4-hydroxy-N-[4-(trifluoromethyl)-2-pyridinyl]benzamide?
The canonical SMILES for 4-hydroxy-N-[4-(trifluoromethyl)-2-pyridinyl]benzamide is O=C(Nc1cc(C(F)(F)F)ccn1)c1ccc(O)cc1.
What is the InChIKey of 4-hydroxy-N-[4-(trifluoromethyl)-2-pyridinyl]benzamide?
The InChIKey is QSMPEOJFIWRDLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9F3N2O2/c14-13(15,16)9-5-6-17-11(7-9)18-12(20)8-1-3-10(19)4-2-8/h1-7,19H,(H,17,18,20).
What are the key properties of 4-hydroxy-N-[4-(trifluoromethyl)-2-pyridinyl]benzamide?
4-hydroxy-N-[4-(trifluoromethyl)-2-pyridinyl]benzamide has a molecular weight of 282.22 g/mol, XLogP of 3.06, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-[4-(trifluoromethyl)-2-pyridinyl]benzamide is sourced from PubChem (CID 118623339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).