2-(2-hydrazinyl-2-oxo-1-phenylethoxy)benzamide

C15H15N3O3 — CID 63576718

IUPAC2-(2-hydrazinyl-2-oxo-1-phenylethoxy)benzamide
SMILESNNC(=O)C(Oc1ccccc1C(N)=O)c1ccccc1
InChIInChI=1S/C15H15N3O3/c16-14(19)11-8-4-5-9-12(11)21-13(15(20)18-17)10-6-2-1-3-7-10/h1-9,13H,17H2,(H2,16,19)(H,18,20)
InChIKeyTYTZIJFKIOININ-UHFFFAOYSA-N
MW285.30 g/mol
LogP0.90
Rot. Bonds5

About 2-(2-hydrazinyl-2-oxo-1-phenylethoxy)benzamide

2-(2-hydrazinyl-2-oxo-1-phenylethoxy)benzamide (PubChem CID 63576718) has the molecular formula C15H15N3O3 and a molecular weight of 285.30 g/mol. Its IUPAC name is 2-(2-hydrazinyl-2-oxo-1-phenylethoxy)benzamide.

Molecular Properties

Compound Name2-(2-hydrazinyl-2-oxo-1-phenylethoxy)benzamide
PubChem CID63576718
Molecular FormulaC15H15N3O3
Molecular Weight285.30 g/mol
Exact Mass285.11
IUPAC Name2-(2-hydrazinyl-2-oxo-1-phenylethoxy)benzamide
SMILESNNC(=O)C(Oc1ccccc1C(N)=O)c1ccccc1
InChIInChI=1S/C15H15N3O3/c16-14(19)11-8-4-5-9-12(11)21-13(15(20)18-17)10-6-2-1-3-7-10/h1-9,13H,17H2,(H2,16,19)(H,18,20)
InChIKeyTYTZIJFKIOININ-UHFFFAOYSA-N
XLogP0.90
TPSA107.44 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.30
LogP ≤ 50.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(2-fluorophenoxy)-2-phenylacetohydrazide
CID 63576514
2-[(1R)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethoxy]benzamide
CID 8001851
2-(4-bromo-2-methylphenoxy)-2-phenylacetohydrazide
CID 63570205
2-(2-chloro-4-methylphenoxy)-2-phenylacetohydrazide
CID 63569668
2-(1-fluoroethoxy)benzamide
CID 57150200
2-(3,5-dimethylphenoxy)-2-phenylacetohydrazide
CID 63576169
2-(2-fluoro-4-formylphenoxy)-2-phenylacetohydrazide
CID 107693702
2-phenylpropanedihydrazide
CID 11424318
2-(2-benzoylphenoxy)-2-phenylacetic acid
CID 135075285
2-(2-carbamoylphenoxy)-3-methylbutanoic acid
CID 18073009
(2-carbamoylphenoxy)carbamic acid
CID 174929401
2-[(1R)-2-(cyclopropylamino)-2-oxo-1-phenylethoxy]-N-phenylbenzamide
CID 9416652

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydrazinyl-2-oxo-1-phenylethoxy)benzamide?
The IUPAC name of 2-(2-hydrazinyl-2-oxo-1-phenylethoxy)benzamide (CID 63576718) is 2-(2-hydrazinyl-2-oxo-1-phenylethoxy)benzamide.
What is the SMILES notation for 2-(2-hydrazinyl-2-oxo-1-phenylethoxy)benzamide?
The canonical SMILES for 2-(2-hydrazinyl-2-oxo-1-phenylethoxy)benzamide is NNC(=O)C(Oc1ccccc1C(N)=O)c1ccccc1.
What is the InChIKey of 2-(2-hydrazinyl-2-oxo-1-phenylethoxy)benzamide?
The InChIKey is TYTZIJFKIOININ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O3/c16-14(19)11-8-4-5-9-12(11)21-13(15(20)18-17)10-6-2-1-3-7-10/h1-9,13H,17H2,(H2,16,19)(H,18,20).
What are the key properties of 2-(2-hydrazinyl-2-oxo-1-phenylethoxy)benzamide?
2-(2-hydrazinyl-2-oxo-1-phenylethoxy)benzamide has a molecular weight of 285.30 g/mol, XLogP of 0.90, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydrazinyl-2-oxo-1-phenylethoxy)benzamide is sourced from PubChem (CID 63576718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).