4-(6-hydrazinylpyridazin-3-yl)-N,N-dimethylaniline

C12H15N5 — CID 62785733

IUPAC4-(6-hydrazinylpyridazin-3-yl)-N,N-dimethylaniline
SMILESCN(C)c1ccc(-c2ccc(NN)nn2)cc1
InChIInChI=1S/C12H15N5/c1-17(2)10-5-3-9(4-6-10)11-7-8-12(14-13)16-15-11/h3-8H,13H2,1-2H3,(H,14,16)
InChIKeySMEKLMIWHLCZML-UHFFFAOYSA-N
MW229.29 g/mol
LogP1.50
Rot. Bonds3

About 4-(6-hydrazinylpyridazin-3-yl)-N,N-dimethylaniline

4-(6-hydrazinylpyridazin-3-yl)-N,N-dimethylaniline (PubChem CID 62785733) has the molecular formula C12H15N5 and a molecular weight of 229.29 g/mol. Its IUPAC name is 4-(6-hydrazinylpyridazin-3-yl)-N,N-dimethylaniline.

Molecular Properties

Compound Name4-(6-hydrazinylpyridazin-3-yl)-N,N-dimethylaniline
PubChem CID62785733
Molecular FormulaC12H15N5
Molecular Weight229.29 g/mol
Exact Mass229.13
IUPAC Name4-(6-hydrazinylpyridazin-3-yl)-N,N-dimethylaniline
SMILESCN(C)c1ccc(-c2ccc(NN)nn2)cc1
InChIInChI=1S/C12H15N5/c1-17(2)10-5-3-9(4-6-10)11-7-8-12(14-13)16-15-11/h3-8H,13H2,1-2H3,(H,14,16)
InChIKeySMEKLMIWHLCZML-UHFFFAOYSA-N
XLogP1.50
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.29
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'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-(6-hydrazinylpyridazin-3-yl)-N,N-dimethylaniline?
The IUPAC name of 4-(6-hydrazinylpyridazin-3-yl)-N,N-dimethylaniline (CID 62785733) is 4-(6-hydrazinylpyridazin-3-yl)-N,N-dimethylaniline.
What is the SMILES notation for 4-(6-hydrazinylpyridazin-3-yl)-N,N-dimethylaniline?
The canonical SMILES for 4-(6-hydrazinylpyridazin-3-yl)-N,N-dimethylaniline is CN(C)c1ccc(-c2ccc(NN)nn2)cc1.
What is the InChIKey of 4-(6-hydrazinylpyridazin-3-yl)-N,N-dimethylaniline?
The InChIKey is SMEKLMIWHLCZML-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5/c1-17(2)10-5-3-9(4-6-10)11-7-8-12(14-13)16-15-11/h3-8H,13H2,1-2H3,(H,14,16).
What are the key properties of 4-(6-hydrazinylpyridazin-3-yl)-N,N-dimethylaniline?
4-(6-hydrazinylpyridazin-3-yl)-N,N-dimethylaniline has a molecular weight of 229.29 g/mol, XLogP of 1.50, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-hydrazinylpyridazin-3-yl)-N,N-dimethylaniline is sourced from PubChem (CID 62785733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).