3-pyridazin-4-ylpropan-1-amine

C7H11N3 — CID 112757524

IUPAC3-pyridazin-4-ylpropan-1-amine
SMILESNCCCc1ccnnc1
InChIInChI=1S/C7H11N3/c8-4-1-2-7-3-5-9-10-6-7/h3,5-6H,1-2,4,8H2
InChIKeyKTYWQAFLEHBHPD-UHFFFAOYSA-N
MW137.19 g/mol
LogP0.37
Rot. Bonds3

About 3-pyridazin-4-ylpropan-1-amine

3-pyridazin-4-ylpropan-1-amine (PubChem CID 112757524) has the molecular formula C7H11N3 and a molecular weight of 137.19 g/mol. Its IUPAC name is 3-pyridazin-4-ylpropan-1-amine.

Molecular Properties

Compound Name3-pyridazin-4-ylpropan-1-amine
PubChem CID112757524
Molecular FormulaC7H11N3
Molecular Weight137.19 g/mol
Exact Mass137.10
IUPAC Name3-pyridazin-4-ylpropan-1-amine
SMILESNCCCc1ccnnc1
InChIInChI=1S/C7H11N3/c8-4-1-2-7-3-5-9-10-6-7/h3,5-6H,1-2,4,8H2
InChIKeyKTYWQAFLEHBHPD-UHFFFAOYSA-N
XLogP0.37
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.19
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-pyridazin-4-ylpropan-1-amine?
The IUPAC name of 3-pyridazin-4-ylpropan-1-amine (CID 112757524) is 3-pyridazin-4-ylpropan-1-amine.
What is the SMILES notation for 3-pyridazin-4-ylpropan-1-amine?
The canonical SMILES for 3-pyridazin-4-ylpropan-1-amine is NCCCc1ccnnc1.
What is the InChIKey of 3-pyridazin-4-ylpropan-1-amine?
The InChIKey is KTYWQAFLEHBHPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3/c8-4-1-2-7-3-5-9-10-6-7/h3,5-6H,1-2,4,8H2.
What are the key properties of 3-pyridazin-4-ylpropan-1-amine?
3-pyridazin-4-ylpropan-1-amine has a molecular weight of 137.19 g/mol, XLogP of 0.37, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyridazin-4-ylpropan-1-amine is sourced from PubChem (CID 112757524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).