N'-pyridin-2-yl-2-(trifluoromethyl)benzohydrazide

C13H10F3N3O — CID 175943084

IUPACN'-pyridin-2-yl-2-(trifluoromethyl)benzohydrazide
SMILESO=C(NNc1ccccn1)c1ccccc1C(F)(F)F
InChIInChI=1S/C13H10F3N3O/c14-13(15,16)10-6-2-1-5-9(10)12(20)19-18-11-7-3-4-8-17-11/h1-8H,(H,17,18)(H,19,20)
InChIKeyXXGUOKVABHGASX-UHFFFAOYSA-N
MW281.24 g/mol
LogP2.86
Rot. Bonds3

About N'-pyridin-2-yl-2-(trifluoromethyl)benzohydrazide

N'-pyridin-2-yl-2-(trifluoromethyl)benzohydrazide (PubChem CID 175943084) has the molecular formula C13H10F3N3O and a molecular weight of 281.24 g/mol. Its IUPAC name is N'-pyridin-2-yl-2-(trifluoromethyl)benzohydrazide.

Molecular Properties

Compound NameN'-pyridin-2-yl-2-(trifluoromethyl)benzohydrazide
PubChem CID175943084
Molecular FormulaC13H10F3N3O
Molecular Weight281.24 g/mol
Exact Mass281.08
IUPAC NameN'-pyridin-2-yl-2-(trifluoromethyl)benzohydrazide
SMILESO=C(NNc1ccccn1)c1ccccc1C(F)(F)F
InChIInChI=1S/C13H10F3N3O/c14-13(15,16)10-6-2-1-5-9(10)12(20)19-18-11-7-3-4-8-17-11/h1-8H,(H,17,18)(H,19,20)
InChIKeyXXGUOKVABHGASX-UHFFFAOYSA-N
XLogP2.86
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.24
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-methyl-2-(trifluoromethyl)benzamide
CID 4216112
N-[phenyl(pyridin-2-yl)methyl]-2-(trifluoromethyl)benzamide
CID 44765282
2-chloro-N-pyridin-2-yl-3-(trifluoromethyl)quinoline-8-carboxamide
CID 87189922
N-(1-pyridin-2-ylpropyl)-2-(trifluoromethyl)benzamide
CID 91775087
N'-pyridin-2-ylpyridine-3-carbohydrazide
CID 69416476
N-(2-phenylpyrimidin-4-yl)-2-(trifluoromethyl)benzamide
CID 71848765
2-phenyl-N-pyridin-2-yl-3-(trifluoromethyl)quinoline-8-carboxamide
CID 58154708
N-quinolin-5-yl-2-(trifluoromethyl)benzamide
CID 26242319
N-(4-hydroxyphenyl)-2-(trifluoromethyl)benzamide
CID 28739363
N'-(2-pyrrol-1-ylbenzoyl)-2-(trifluoromethyl)benzohydrazide
CID 4807808
N'-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-2-(trifluoromethyl)benzohydrazide
CID 43935386
2-cyclopentylsulfanyl-N'-[2-(trifluoromethyl)phenyl]pyridine-3-carbohydrazide
CID 55884147

Frequently Asked Questions

What is the IUPAC name of N'-pyridin-2-yl-2-(trifluoromethyl)benzohydrazide?
The IUPAC name of N'-pyridin-2-yl-2-(trifluoromethyl)benzohydrazide (CID 175943084) is N'-pyridin-2-yl-2-(trifluoromethyl)benzohydrazide.
What is the SMILES notation for N'-pyridin-2-yl-2-(trifluoromethyl)benzohydrazide?
The canonical SMILES for N'-pyridin-2-yl-2-(trifluoromethyl)benzohydrazide is O=C(NNc1ccccn1)c1ccccc1C(F)(F)F.
What is the InChIKey of N'-pyridin-2-yl-2-(trifluoromethyl)benzohydrazide?
The InChIKey is XXGUOKVABHGASX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F3N3O/c14-13(15,16)10-6-2-1-5-9(10)12(20)19-18-11-7-3-4-8-17-11/h1-8H,(H,17,18)(H,19,20).
What are the key properties of N'-pyridin-2-yl-2-(trifluoromethyl)benzohydrazide?
N'-pyridin-2-yl-2-(trifluoromethyl)benzohydrazide has a molecular weight of 281.24 g/mol, XLogP of 2.86, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-pyridin-2-yl-2-(trifluoromethyl)benzohydrazide is sourced from PubChem (CID 175943084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).