N'-benzyl-2,2,2-trifluoro-N'-phenylacetohydrazide

C15H13F3N2O — CID 71671643

IUPACN'-benzyl-2,2,2-trifluoro-N'-phenylacetohydrazide
SMILESO=C(NN(Cc1ccccc1)c1ccccc1)C(F)(F)F
InChIInChI=1S/C15H13F3N2O/c16-15(17,18)14(21)19-20(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-10H,11H2,(H,19,21)
InChIKeyWYQYNZJGZIFWMG-UHFFFAOYSA-N
MW294.28 g/mol
LogP3.29
Rot. Bonds4

About N'-benzyl-2,2,2-trifluoro-N'-phenylacetohydrazide

N'-benzyl-2,2,2-trifluoro-N'-phenylacetohydrazide (PubChem CID 71671643) has the molecular formula C15H13F3N2O and a molecular weight of 294.28 g/mol. Its IUPAC name is N'-benzyl-2,2,2-trifluoro-N'-phenylacetohydrazide.

Molecular Properties

Compound NameN'-benzyl-2,2,2-trifluoro-N'-phenylacetohydrazide
PubChem CID71671643
Molecular FormulaC15H13F3N2O
Molecular Weight294.28 g/mol
Exact Mass294.10
IUPAC NameN'-benzyl-2,2,2-trifluoro-N'-phenylacetohydrazide
SMILESO=C(NN(Cc1ccccc1)c1ccccc1)C(F)(F)F
InChIInChI=1S/C15H13F3N2O/c16-15(17,18)14(21)19-20(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-10H,11H2,(H,19,21)
InChIKeyWYQYNZJGZIFWMG-UHFFFAOYSA-N
XLogP3.29
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.28
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N'-benzyl-N'-phenyl-2-(trifluoromethyl)benzohydrazide
CID 55342142
N'-benzyl-N'-phenylfuran-2-carbohydrazide
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tert-butyl N-(N-benzyl-4-fluoroanilino)carbamate
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N-[2-(2-benzyl-2-phenylhydrazinyl)-2-oxoethyl]-2-methylbutanamide
CID 60550490
N'-benzyl-N'-phenylpyridine-3-carbohydrazide
CID 51156325
N'-benzyl-3-methyl-N'-phenylthiophene-2-carbohydrazide
CID 39477042
benzyl N-[2-(2-benzyl-2-phenylhydrazinyl)-2-oxoethyl]carbamate
CID 60596176
N-[3-[benzyl(methyl)amino]propyl]-2,2,2-trifluoroacetamide
CID 62490939
N,N-diphenylaniline;2,2,2-trifluoroacetic acid
CID 162535406
N'-benzyl-3-chloro-4-hydroxy-N'-phenylbenzohydrazide
CID 75479031
tert-butyl N-(N-benzyl-4-methoxyanilino)carbamate
CID 122213269

Frequently Asked Questions

What is the IUPAC name of N'-benzyl-2,2,2-trifluoro-N'-phenylacetohydrazide?
The IUPAC name of N'-benzyl-2,2,2-trifluoro-N'-phenylacetohydrazide (CID 71671643) is N'-benzyl-2,2,2-trifluoro-N'-phenylacetohydrazide.
What is the SMILES notation for N'-benzyl-2,2,2-trifluoro-N'-phenylacetohydrazide?
The canonical SMILES for N'-benzyl-2,2,2-trifluoro-N'-phenylacetohydrazide is O=C(NN(Cc1ccccc1)c1ccccc1)C(F)(F)F.
What is the InChIKey of N'-benzyl-2,2,2-trifluoro-N'-phenylacetohydrazide?
The InChIKey is WYQYNZJGZIFWMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F3N2O/c16-15(17,18)14(21)19-20(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-10H,11H2,(H,19,21).
What are the key properties of N'-benzyl-2,2,2-trifluoro-N'-phenylacetohydrazide?
N'-benzyl-2,2,2-trifluoro-N'-phenylacetohydrazide has a molecular weight of 294.28 g/mol, XLogP of 3.29, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-benzyl-2,2,2-trifluoro-N'-phenylacetohydrazide is sourced from PubChem (CID 71671643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).