3-phenylmethoxybenzohydrazide

C14H14N2O2 — CID 2735491

IUPAC3-phenylmethoxybenzohydrazide
SMILESNNC(=O)c1cccc(OCc2ccccc2)c1
InChIInChI=1S/C14H14N2O2/c15-16-14(17)12-7-4-8-13(9-12)18-10-11-5-2-1-3-6-11/h1-9H,10,15H2,(H,16,17)
InChIKeyJKJQCSNZIBXALH-UHFFFAOYSA-N
MW242.28 g/mol
LogP1.87
Rot. Bonds4

About 3-phenylmethoxybenzohydrazide

3-phenylmethoxybenzohydrazide (PubChem CID 2735491) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is 3-phenylmethoxybenzohydrazide.

Molecular Properties

Compound Name3-phenylmethoxybenzohydrazide
PubChem CID2735491
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Name3-phenylmethoxybenzohydrazide
SMILESNNC(=O)c1cccc(OCc2ccccc2)c1
InChIInChI=1S/C14H14N2O2/c15-16-14(17)12-7-4-8-13(9-12)18-10-11-5-2-1-3-6-11/h1-9H,10,15H2,(H,16,17)
InChIKeyJKJQCSNZIBXALH-UHFFFAOYSA-N
XLogP1.87
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

3-Methoxybenzamide
CID 98487
4-Methoxybenzohydrazide
CID 76792
o-Anisohydrazide
CID 24051
2-(Benzyloxy)benzohydrazide
CID 935766
N'1,N'6-bis(4-methoxybenzoyl)hexanedihydrazide
CID 3115394
1-Benzoyl-2-(3-methoxybenzoyl)hydrazine
CID 252264
4-Ethoxybenzhydrazide
CID 143561
3,5-Dimethoxybenzohydrazide
CID 352312
4-(4-Carbamoylphenoxy)benzamide
CID 236501
Parp10-IN-3
CID 69845715
N'-[(2E)-5,5,6,6,7,7,7-Heptafluoro-4-oxohept-2-en-2-yl]-3-methoxybenzohydrazide
CID 5753962
2-methoxy-N'-(phenylcarbonyl)benzohydrazide
CID 790049

Frequently Asked Questions

What is the IUPAC name of 3-phenylmethoxybenzohydrazide?
The IUPAC name of 3-phenylmethoxybenzohydrazide (CID 2735491) is 3-phenylmethoxybenzohydrazide.
What is the SMILES notation for 3-phenylmethoxybenzohydrazide?
The canonical SMILES for 3-phenylmethoxybenzohydrazide is NNC(=O)c1cccc(OCc2ccccc2)c1.
What is the InChIKey of 3-phenylmethoxybenzohydrazide?
The InChIKey is JKJQCSNZIBXALH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c15-16-14(17)12-7-4-8-13(9-12)18-10-11-5-2-1-3-6-11/h1-9H,10,15H2,(H,16,17).
What are the key properties of 3-phenylmethoxybenzohydrazide?
3-phenylmethoxybenzohydrazide has a molecular weight of 242.28 g/mol, XLogP of 1.87, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenylmethoxybenzohydrazide is sourced from PubChem (CID 2735491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).