N-(5-cyclopropyl-1H-pyrazol-3-yl)-6-(4-methylpiperazin-1-yl)pyridazin-3-amine

C15H21N7 — CID 171351810

IUPACN-(5-cyclopropyl-1H-pyrazol-3-yl)-6-(4-methylpiperazin-1-yl)pyridazin-3-amine
SMILESCN1CCN(c2ccc(Nc3cc(C4CC4)[nH]n3)nn2)CC1
InChIInChI=1S/C15H21N7/c1-21-6-8-22(9-7-21)15-5-4-13(18-20-15)16-14-10-12(17-19-14)11-2-3-11/h4-5,10-11H,2-3,6-9H2,1H3,(H2,16,17,18,19)
InChIKeyGSOMOBPFGHZNTE-UHFFFAOYSA-N
MW299.38 g/mol
LogP1.57
Rot. Bonds4

About N-(5-cyclopropyl-1H-pyrazol-3-yl)-6-(4-methylpiperazin-1-yl)pyridazin-3-amine

N-(5-cyclopropyl-1H-pyrazol-3-yl)-6-(4-methylpiperazin-1-yl)pyridazin-3-amine (PubChem CID 171351810) has the molecular formula C15H21N7 and a molecular weight of 299.38 g/mol. Its IUPAC name is N-(5-cyclopropyl-1H-pyrazol-3-yl)-6-(4-methylpiperazin-1-yl)pyridazin-3-amine.

Molecular Properties

Compound NameN-(5-cyclopropyl-1H-pyrazol-3-yl)-6-(4-methylpiperazin-1-yl)pyridazin-3-amine
PubChem CID171351810
Molecular FormulaC15H21N7
Molecular Weight299.38 g/mol
Exact Mass299.19
IUPAC NameN-(5-cyclopropyl-1H-pyrazol-3-yl)-6-(4-methylpiperazin-1-yl)pyridazin-3-amine
SMILESCN1CCN(c2ccc(Nc3cc(C4CC4)[nH]n3)nn2)CC1
InChIInChI=1S/C15H21N7/c1-21-6-8-22(9-7-21)15-5-4-13(18-20-15)16-14-10-12(17-19-14)11-2-3-11/h4-5,10-11H,2-3,6-9H2,1H3,(H2,16,17,18,19)
InChIKeyGSOMOBPFGHZNTE-UHFFFAOYSA-N
XLogP1.57
TPSA72.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.38
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)-6-(4-methylpiperazin-1-yl)pyridazin-3-amine?
The IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)-6-(4-methylpiperazin-1-yl)pyridazin-3-amine (CID 171351810) is N-(5-cyclopropyl-1H-pyrazol-3-yl)-6-(4-methylpiperazin-1-yl)pyridazin-3-amine.
What is the SMILES notation for N-(5-cyclopropyl-1H-pyrazol-3-yl)-6-(4-methylpiperazin-1-yl)pyridazin-3-amine?
The canonical SMILES for N-(5-cyclopropyl-1H-pyrazol-3-yl)-6-(4-methylpiperazin-1-yl)pyridazin-3-amine is CN1CCN(c2ccc(Nc3cc(C4CC4)[nH]n3)nn2)CC1.
What is the InChIKey of N-(5-cyclopropyl-1H-pyrazol-3-yl)-6-(4-methylpiperazin-1-yl)pyridazin-3-amine?
The InChIKey is GSOMOBPFGHZNTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N7/c1-21-6-8-22(9-7-21)15-5-4-13(18-20-15)16-14-10-12(17-19-14)11-2-3-11/h4-5,10-11H,2-3,6-9H2,1H3,(H2,16,17,18,19).
What are the key properties of N-(5-cyclopropyl-1H-pyrazol-3-yl)-6-(4-methylpiperazin-1-yl)pyridazin-3-amine?
N-(5-cyclopropyl-1H-pyrazol-3-yl)-6-(4-methylpiperazin-1-yl)pyridazin-3-amine has a molecular weight of 299.38 g/mol, XLogP of 1.57, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclopropyl-1H-pyrazol-3-yl)-6-(4-methylpiperazin-1-yl)pyridazin-3-amine is sourced from PubChem (CID 171351810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).