4-aminobenzohydrazide

C7H9N3O — CID 21450

IUPAC4-aminobenzohydrazide
SMILESNNC(=O)c1ccc(N)cc1
InChIInChI=1S/C7H9N3O/c8-6-3-1-5(2-4-6)7(11)10-9/h1-4H,8-9H2,(H,10,11)
InChIKeyWPBZMCGPFHZRHJ-UHFFFAOYSA-N
MW151.17 g/mol
LogP-0.13
Rot. Bonds1

About 4-aminobenzohydrazide

4-aminobenzohydrazide (PubChem CID 21450) has the molecular formula C7H9N3O and a molecular weight of 151.17 g/mol. Its IUPAC name is 4-aminobenzohydrazide.

Molecular Properties

Compound Name4-aminobenzohydrazide
PubChem CID21450
Molecular FormulaC7H9N3O
Molecular Weight151.17 g/mol
Exact Mass151.07
IUPAC Name4-aminobenzohydrazide
SMILESNNC(=O)c1ccc(N)cc1
InChIInChI=1S/C7H9N3O/c8-6-3-1-5(2-4-6)7(11)10-9/h1-4H,8-9H2,(H,10,11)
InChIKeyWPBZMCGPFHZRHJ-UHFFFAOYSA-N
XLogP-0.13
TPSA81.14 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.17
LogP ≤ 5-0.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-aminobenzohydrazide?
The IUPAC name of 4-aminobenzohydrazide (CID 21450) is 4-aminobenzohydrazide.
What is the SMILES notation for 4-aminobenzohydrazide?
The canonical SMILES for 4-aminobenzohydrazide is NNC(=O)c1ccc(N)cc1.
What is the InChIKey of 4-aminobenzohydrazide?
The InChIKey is WPBZMCGPFHZRHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O/c8-6-3-1-5(2-4-6)7(11)10-9/h1-4H,8-9H2,(H,10,11).
What are the key properties of 4-aminobenzohydrazide?
4-aminobenzohydrazide has a molecular weight of 151.17 g/mol, XLogP of -0.13, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-aminobenzohydrazide is sourced from PubChem (CID 21450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).