6-hydrazinyl-N-propan-2-ylpyridazin-3-amine

C7H13N5 — CID 3043964

IUPAC6-hydrazinyl-N-propan-2-ylpyridazin-3-amine
SMILESCC(C)Nc1ccc(NN)nn1
InChIInChI=1S/C7H13N5/c1-5(2)9-6-3-4-7(10-8)12-11-6/h3-5H,8H2,1-2H3,(H,9,11)(H,10,12)
InChIKeyXIMDCYUVDGBLOE-UHFFFAOYSA-N
MW167.22 g/mol
LogP0.58
Rot. Bonds3

About 6-hydrazinyl-N-propan-2-ylpyridazin-3-amine

6-hydrazinyl-N-propan-2-ylpyridazin-3-amine (PubChem CID 3043964) has the molecular formula C7H13N5 and a molecular weight of 167.22 g/mol. Its IUPAC name is 6-hydrazinyl-N-propan-2-ylpyridazin-3-amine.

Molecular Properties

Compound Name6-hydrazinyl-N-propan-2-ylpyridazin-3-amine
PubChem CID3043964
Molecular FormulaC7H13N5
Molecular Weight167.22 g/mol
Exact Mass167.12
IUPAC Name6-hydrazinyl-N-propan-2-ylpyridazin-3-amine
SMILESCC(C)Nc1ccc(NN)nn1
InChIInChI=1S/C7H13N5/c1-5(2)9-6-3-4-7(10-8)12-11-6/h3-5H,8H2,1-2H3,(H,9,11)(H,10,12)
InChIKeyXIMDCYUVDGBLOE-UHFFFAOYSA-N
XLogP0.58
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.22
LogP ≤ 50.58
H-Bond Donors ≤ 53
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 6-hydrazinyl-N-propan-2-ylpyridazin-3-amine?
The IUPAC name of 6-hydrazinyl-N-propan-2-ylpyridazin-3-amine (CID 3043964) is 6-hydrazinyl-N-propan-2-ylpyridazin-3-amine.
What is the SMILES notation for 6-hydrazinyl-N-propan-2-ylpyridazin-3-amine?
The canonical SMILES for 6-hydrazinyl-N-propan-2-ylpyridazin-3-amine is CC(C)Nc1ccc(NN)nn1.
What is the InChIKey of 6-hydrazinyl-N-propan-2-ylpyridazin-3-amine?
The InChIKey is XIMDCYUVDGBLOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N5/c1-5(2)9-6-3-4-7(10-8)12-11-6/h3-5H,8H2,1-2H3,(H,9,11)(H,10,12).
What are the key properties of 6-hydrazinyl-N-propan-2-ylpyridazin-3-amine?
6-hydrazinyl-N-propan-2-ylpyridazin-3-amine has a molecular weight of 167.22 g/mol, XLogP of 0.58, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-propan-2-ylpyridazin-3-amine is sourced from PubChem (CID 3043964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).