(3-methylmorpholin-4-yl)-[6-(propylamino)pyridazin-3-yl]methanone

C13H20N4O2 — CID 62169207

IUPAC(3-methylmorpholin-4-yl)-[6-(propylamino)pyridazin-3-yl]methanone
SMILESCCCNc1ccc(C(=O)N2CCOCC2C)nn1
InChIInChI=1S/C13H20N4O2/c1-3-6-14-12-5-4-11(15-16-12)13(18)17-7-8-19-9-10(17)2/h4-5,10H,3,6-9H2,1-2H3,(H,14,16)
InChIKeyMPZOLJALBSGZQL-UHFFFAOYSA-N
MW264.33 g/mol
LogP1.16
Rot. Bonds4

About (3-methylmorpholin-4-yl)-[6-(propylamino)pyridazin-3-yl]methanone

(3-methylmorpholin-4-yl)-[6-(propylamino)pyridazin-3-yl]methanone (PubChem CID 62169207) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is (3-methylmorpholin-4-yl)-[6-(propylamino)pyridazin-3-yl]methanone.

Molecular Properties

Compound Name(3-methylmorpholin-4-yl)-[6-(propylamino)pyridazin-3-yl]methanone
PubChem CID62169207
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name(3-methylmorpholin-4-yl)-[6-(propylamino)pyridazin-3-yl]methanone
SMILESCCCNc1ccc(C(=O)N2CCOCC2C)nn1
InChIInChI=1S/C13H20N4O2/c1-3-6-14-12-5-4-11(15-16-12)13(18)17-7-8-19-9-10(17)2/h4-5,10H,3,6-9H2,1-2H3,(H,14,16)
InChIKeyMPZOLJALBSGZQL-UHFFFAOYSA-N
XLogP1.16
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (3-methylmorpholin-4-yl)-[6-(propylamino)pyridazin-3-yl]methanone?
The IUPAC name of (3-methylmorpholin-4-yl)-[6-(propylamino)pyridazin-3-yl]methanone (CID 62169207) is (3-methylmorpholin-4-yl)-[6-(propylamino)pyridazin-3-yl]methanone.
What is the SMILES notation for (3-methylmorpholin-4-yl)-[6-(propylamino)pyridazin-3-yl]methanone?
The canonical SMILES for (3-methylmorpholin-4-yl)-[6-(propylamino)pyridazin-3-yl]methanone is CCCNc1ccc(C(=O)N2CCOCC2C)nn1.
What is the InChIKey of (3-methylmorpholin-4-yl)-[6-(propylamino)pyridazin-3-yl]methanone?
The InChIKey is MPZOLJALBSGZQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-3-6-14-12-5-4-11(15-16-12)13(18)17-7-8-19-9-10(17)2/h4-5,10H,3,6-9H2,1-2H3,(H,14,16).
What are the key properties of (3-methylmorpholin-4-yl)-[6-(propylamino)pyridazin-3-yl]methanone?
(3-methylmorpholin-4-yl)-[6-(propylamino)pyridazin-3-yl]methanone has a molecular weight of 264.33 g/mol, XLogP of 1.16, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methylmorpholin-4-yl)-[6-(propylamino)pyridazin-3-yl]methanone is sourced from PubChem (CID 62169207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).