2-(diphenylhydrazinylidene)propanoic acid

C15H14N2O2 — CID 4737078

IUPAC2-(diphenylhydrazinylidene)propanoic acid
SMILESCC(=NN(c1ccccc1)c1ccccc1)C(=O)O
InChIInChI=1S/C15H14N2O2/c1-12(15(18)19)16-17(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11H,1H3,(H,18,19)
InChIKeyIAQHZVFSUPXHKJ-UHFFFAOYSA-N
MW254.29 g/mol
LogP3.29
Rot. Bonds4

About 2-(diphenylhydrazinylidene)propanoic acid

2-(diphenylhydrazinylidene)propanoic acid (PubChem CID 4737078) has the molecular formula C15H14N2O2 and a molecular weight of 254.29 g/mol. Its IUPAC name is 2-(diphenylhydrazinylidene)propanoic acid.

Molecular Properties

Compound Name2-(diphenylhydrazinylidene)propanoic acid
PubChem CID4737078
Molecular FormulaC15H14N2O2
Molecular Weight254.29 g/mol
Exact Mass254.11
IUPAC Name2-(diphenylhydrazinylidene)propanoic acid
SMILESCC(=NN(c1ccccc1)c1ccccc1)C(=O)O
InChIInChI=1S/C15H14N2O2/c1-12(15(18)19)16-17(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11H,1H3,(H,18,19)
InChIKeyIAQHZVFSUPXHKJ-UHFFFAOYSA-N
XLogP3.29
TPSA52.90 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[methyl(phenyl)hydrazinylidene]propanedioic acid
CID 165345794
N-[4-(N-acetylanilino)phenyl]-N-phenylacetamide
CID 14470893
3-phenyliminobutan-2-one
CID 12823040
ethyl 2-[methyl(phenyl)hydrazinylidene]propanoate
CID 72730658
1,1-bis(N-phenylanilino)propan-2-one
CID 141093268
2-(N-carboxyanilino)-2-oxoacetic acid
CID 69036482
(2E,3E)-2,3-bis(hydroxyimino)-N-methyl-N-phenylbutanamide
CID 135666294
methyl (2E)-2-[ethenyl(phenyl)hydrazinylidene]propanoate
CID 143469941
sodium;N,N-difluoroaniline;acetate
CID 162315438
N-phenyl-N-thionitrosoaniline
CID 88846762
2-[(E)-1-(2-hydroxyphenyl)ethylidenehydrazinylidene]propanoic acid
CID 137035148
2-[ethyl-(2-methylsulfonyloxyphenyl)hydrazinylidene]propanoic acid
CID 139763391

Frequently Asked Questions

What is the IUPAC name of 2-(diphenylhydrazinylidene)propanoic acid?
The IUPAC name of 2-(diphenylhydrazinylidene)propanoic acid (CID 4737078) is 2-(diphenylhydrazinylidene)propanoic acid.
What is the SMILES notation for 2-(diphenylhydrazinylidene)propanoic acid?
The canonical SMILES for 2-(diphenylhydrazinylidene)propanoic acid is CC(=NN(c1ccccc1)c1ccccc1)C(=O)O.
What is the InChIKey of 2-(diphenylhydrazinylidene)propanoic acid?
The InChIKey is IAQHZVFSUPXHKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O2/c1-12(15(18)19)16-17(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11H,1H3,(H,18,19).
What are the key properties of 2-(diphenylhydrazinylidene)propanoic acid?
2-(diphenylhydrazinylidene)propanoic acid has a molecular weight of 254.29 g/mol, XLogP of 3.29, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diphenylhydrazinylidene)propanoic acid is sourced from PubChem (CID 4737078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).