N-methyl-6-[(2-methyl-3-morpholin-4-ylpropyl)amino]pyridazine-3-carboxamide

C14H23N5O2 — CID 133340039

IUPACN-methyl-6-[(2-methyl-3-morpholin-4-ylpropyl)amino]pyridazine-3-carboxamide
SMILESCNC(=O)c1ccc(NCC(C)CN2CCOCC2)nn1
InChIInChI=1S/C14H23N5O2/c1-11(10-19-5-7-21-8-6-19)9-16-13-4-3-12(17-18-13)14(20)15-2/h3-4,11H,5-10H2,1-2H3,(H,15,20)(H,16,18)
InChIKeyGGYRNHNRJIWMOH-UHFFFAOYSA-N
MW293.37 g/mol
LogP0.22
Rot. Bonds6

About N-methyl-6-[(2-methyl-3-morpholin-4-ylpropyl)amino]pyridazine-3-carboxamide

N-methyl-6-[(2-methyl-3-morpholin-4-ylpropyl)amino]pyridazine-3-carboxamide (PubChem CID 133340039) has the molecular formula C14H23N5O2 and a molecular weight of 293.37 g/mol. Its IUPAC name is N-methyl-6-[(2-methyl-3-morpholin-4-ylpropyl)amino]pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-6-[(2-methyl-3-morpholin-4-ylpropyl)amino]pyridazine-3-carboxamide
PubChem CID133340039
Molecular FormulaC14H23N5O2
Molecular Weight293.37 g/mol
Exact Mass293.19
IUPAC NameN-methyl-6-[(2-methyl-3-morpholin-4-ylpropyl)amino]pyridazine-3-carboxamide
SMILESCNC(=O)c1ccc(NCC(C)CN2CCOCC2)nn1
InChIInChI=1S/C14H23N5O2/c1-11(10-19-5-7-21-8-6-19)9-16-13-4-3-12(17-18-13)14(20)15-2/h3-4,11H,5-10H2,1-2H3,(H,15,20)(H,16,18)
InChIKeyGGYRNHNRJIWMOH-UHFFFAOYSA-N
XLogP0.22
TPSA79.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-[(2-methyl-3-morpholin-4-ylpropyl)amino]pyridazine-3-carboxamide?
The IUPAC name of N-methyl-6-[(2-methyl-3-morpholin-4-ylpropyl)amino]pyridazine-3-carboxamide (CID 133340039) is N-methyl-6-[(2-methyl-3-morpholin-4-ylpropyl)amino]pyridazine-3-carboxamide.
What is the SMILES notation for N-methyl-6-[(2-methyl-3-morpholin-4-ylpropyl)amino]pyridazine-3-carboxamide?
The canonical SMILES for N-methyl-6-[(2-methyl-3-morpholin-4-ylpropyl)amino]pyridazine-3-carboxamide is CNC(=O)c1ccc(NCC(C)CN2CCOCC2)nn1.
What is the InChIKey of N-methyl-6-[(2-methyl-3-morpholin-4-ylpropyl)amino]pyridazine-3-carboxamide?
The InChIKey is GGYRNHNRJIWMOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O2/c1-11(10-19-5-7-21-8-6-19)9-16-13-4-3-12(17-18-13)14(20)15-2/h3-4,11H,5-10H2,1-2H3,(H,15,20)(H,16,18).
What are the key properties of N-methyl-6-[(2-methyl-3-morpholin-4-ylpropyl)amino]pyridazine-3-carboxamide?
N-methyl-6-[(2-methyl-3-morpholin-4-ylpropyl)amino]pyridazine-3-carboxamide has a molecular weight of 293.37 g/mol, XLogP of 0.22, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-[(2-methyl-3-morpholin-4-ylpropyl)amino]pyridazine-3-carboxamide is sourced from PubChem (CID 133340039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).