4-(4-hydrazinylphenyl)aniline

C12H13N3 — CID 55280318

IUPAC4-(4-hydrazinylphenyl)aniline
SMILESNNc1ccc(-c2ccc(N)cc2)cc1
InChIInChI=1S/C12H13N3/c13-11-5-1-9(2-6-11)10-3-7-12(15-14)8-4-10/h1-8,15H,13-14H2
InChIKeyNSHASKKYXZBOBF-UHFFFAOYSA-N
MW199.26 g/mol
LogP2.22
Rot. Bonds2

About 4-(4-hydrazinylphenyl)aniline

4-(4-hydrazinylphenyl)aniline (PubChem CID 55280318) has the molecular formula C12H13N3 and a molecular weight of 199.26 g/mol. Its IUPAC name is 4-(4-hydrazinylphenyl)aniline.

Molecular Properties

Compound Name4-(4-hydrazinylphenyl)aniline
PubChem CID55280318
Molecular FormulaC12H13N3
Molecular Weight199.26 g/mol
Exact Mass199.11
IUPAC Name4-(4-hydrazinylphenyl)aniline
SMILESNNc1ccc(-c2ccc(N)cc2)cc1
InChIInChI=1S/C12H13N3/c13-11-5-1-9(2-6-11)10-3-7-12(15-14)8-4-10/h1-8,15H,13-14H2
InChIKeyNSHASKKYXZBOBF-UHFFFAOYSA-N
XLogP2.22
TPSA64.07 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.26
LogP ≤ 52.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'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-(4-hydrazinylphenyl)aniline?
The IUPAC name of 4-(4-hydrazinylphenyl)aniline (CID 55280318) is 4-(4-hydrazinylphenyl)aniline.
What is the SMILES notation for 4-(4-hydrazinylphenyl)aniline?
The canonical SMILES for 4-(4-hydrazinylphenyl)aniline is NNc1ccc(-c2ccc(N)cc2)cc1.
What is the InChIKey of 4-(4-hydrazinylphenyl)aniline?
The InChIKey is NSHASKKYXZBOBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3/c13-11-5-1-9(2-6-11)10-3-7-12(15-14)8-4-10/h1-8,15H,13-14H2.
What are the key properties of 4-(4-hydrazinylphenyl)aniline?
4-(4-hydrazinylphenyl)aniline has a molecular weight of 199.26 g/mol, XLogP of 2.22, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-hydrazinylphenyl)aniline is sourced from PubChem (CID 55280318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).