4-methoxy-N'-(2-phenylacetyl)benzohydrazide

C16H16N2O3 — CID 695069

IUPAC4-methoxy-N'-(2-phenylacetyl)benzohydrazide
SMILESCOc1ccc(C(=O)NNC(=O)Cc2ccccc2)cc1
InChIInChI=1S/C16H16N2O3/c1-21-14-9-7-13(8-10-14)16(20)18-17-15(19)11-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H,17,19)(H,18,20)
InChIKeyBJVRKPCYZSFHDT-UHFFFAOYSA-N
MW284.32 g/mol
LogP1.70
Rot. Bonds4

About 4-methoxy-N'-(2-phenylacetyl)benzohydrazide

4-methoxy-N'-(2-phenylacetyl)benzohydrazide (PubChem CID 695069) has the molecular formula C16H16N2O3 and a molecular weight of 284.32 g/mol. Its IUPAC name is 4-methoxy-N'-(2-phenylacetyl)benzohydrazide.

Molecular Properties

Compound Name4-methoxy-N'-(2-phenylacetyl)benzohydrazide
PubChem CID695069
Molecular FormulaC16H16N2O3
Molecular Weight284.32 g/mol
Exact Mass284.12
IUPAC Name4-methoxy-N'-(2-phenylacetyl)benzohydrazide
SMILESCOc1ccc(C(=O)NNC(=O)Cc2ccccc2)cc1
InChIInChI=1S/C16H16N2O3/c1-21-14-9-7-13(8-10-14)16(20)18-17-15(19)11-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H,17,19)(H,18,20)
InChIKeyBJVRKPCYZSFHDT-UHFFFAOYSA-N
XLogP1.70
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 51.70
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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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N'-(2-phenylacetyl)benzohydrazide?
The IUPAC name of 4-methoxy-N'-(2-phenylacetyl)benzohydrazide (CID 695069) is 4-methoxy-N'-(2-phenylacetyl)benzohydrazide.
What is the SMILES notation for 4-methoxy-N'-(2-phenylacetyl)benzohydrazide?
The canonical SMILES for 4-methoxy-N'-(2-phenylacetyl)benzohydrazide is COc1ccc(C(=O)NNC(=O)Cc2ccccc2)cc1.
What is the InChIKey of 4-methoxy-N'-(2-phenylacetyl)benzohydrazide?
The InChIKey is BJVRKPCYZSFHDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O3/c1-21-14-9-7-13(8-10-14)16(20)18-17-15(19)11-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H,17,19)(H,18,20).
What are the key properties of 4-methoxy-N'-(2-phenylacetyl)benzohydrazide?
4-methoxy-N'-(2-phenylacetyl)benzohydrazide has a molecular weight of 284.32 g/mol, XLogP of 1.70, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N'-(2-phenylacetyl)benzohydrazide is sourced from PubChem (CID 695069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).