N-[3-(dimethylamino)propyl]-N-ethyl-6-(methylamino)pyridazine-3-carboxamide

C13H23N5O — CID 102996743

IUPACN-[3-(dimethylamino)propyl]-N-ethyl-6-(methylamino)pyridazine-3-carboxamide
SMILESCCN(CCCN(C)C)C(=O)c1ccc(NC)nn1
InChIInChI=1S/C13H23N5O/c1-5-18(10-6-9-17(3)4)13(19)11-7-8-12(14-2)16-15-11/h7-8H,5-6,9-10H2,1-4H3,(H,14,16)
InChIKeyDEBOLYJOLFXTJV-UHFFFAOYSA-N
MW265.36 g/mol
LogP0.93
Rot. Bonds7

About N-[3-(dimethylamino)propyl]-N-ethyl-6-(methylamino)pyridazine-3-carboxamide

N-[3-(dimethylamino)propyl]-N-ethyl-6-(methylamino)pyridazine-3-carboxamide (PubChem CID 102996743) has the molecular formula C13H23N5O and a molecular weight of 265.36 g/mol. Its IUPAC name is N-[3-(dimethylamino)propyl]-N-ethyl-6-(methylamino)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)propyl]-N-ethyl-6-(methylamino)pyridazine-3-carboxamide
PubChem CID102996743
Molecular FormulaC13H23N5O
Molecular Weight265.36 g/mol
Exact Mass265.19
IUPAC NameN-[3-(dimethylamino)propyl]-N-ethyl-6-(methylamino)pyridazine-3-carboxamide
SMILESCCN(CCCN(C)C)C(=O)c1ccc(NC)nn1
InChIInChI=1S/C13H23N5O/c1-5-18(10-6-9-17(3)4)13(19)11-7-8-12(14-2)16-15-11/h7-8H,5-6,9-10H2,1-4H3,(H,14,16)
InChIKeyDEBOLYJOLFXTJV-UHFFFAOYSA-N
XLogP0.93
TPSA61.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-ethoxyethyl)-N-ethyl-6-(methylamino)pyridazine-3-carboxamide
CID 63691498
N-ethyl-6-(methylamino)-N-(2-methylpropyl)pyridazine-3-carboxamide
CID 62168964
N-(2-hydroxyethyl)-N-methyl-6-(methylamino)pyridazine-3-carboxamide
CID 62180605
N,N-bis(cyanomethyl)-6-(methylamino)pyridazine-3-carboxamide
CID 62186917
N-cyclopropyl-N-ethyl-6-(methylamino)pyridazine-3-carboxamide
CID 62168086
N,N-dibutyl-6-(ethylamino)pyridazine-3-carboxamide
CID 62167195
N-[3-(dimethylamino)propyl]-N-ethyl-2H-triazole-4-carboxamide
CID 102978833
N-(2-cyanoethyl)-N-ethyl-6-hydrazinylpyridazine-3-carboxamide
CID 62248946
N-[3-(dimethylamino)propyl]-N-ethyl-6-(ethylamino)pyridine-3-carboxamide
CID 102996750
N-[3-(dimethylamino)propyl]-6-[3-(dimethylamino)propylamino]pyridazine-3-carboxamide
CID 109115782
N-cyclohexyl-N-ethyl-6-(methylamino)pyridazine-3-carboxamide
CID 55042606
N-(2-methoxyethyl)-6-(methylamino)-N-(2-methylpropyl)pyridazine-3-carboxamide
CID 62180313

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)propyl]-N-ethyl-6-(methylamino)pyridazine-3-carboxamide?
The IUPAC name of N-[3-(dimethylamino)propyl]-N-ethyl-6-(methylamino)pyridazine-3-carboxamide (CID 102996743) is N-[3-(dimethylamino)propyl]-N-ethyl-6-(methylamino)pyridazine-3-carboxamide.
What is the SMILES notation for N-[3-(dimethylamino)propyl]-N-ethyl-6-(methylamino)pyridazine-3-carboxamide?
The canonical SMILES for N-[3-(dimethylamino)propyl]-N-ethyl-6-(methylamino)pyridazine-3-carboxamide is CCN(CCCN(C)C)C(=O)c1ccc(NC)nn1.
What is the InChIKey of N-[3-(dimethylamino)propyl]-N-ethyl-6-(methylamino)pyridazine-3-carboxamide?
The InChIKey is DEBOLYJOLFXTJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O/c1-5-18(10-6-9-17(3)4)13(19)11-7-8-12(14-2)16-15-11/h7-8H,5-6,9-10H2,1-4H3,(H,14,16).
What are the key properties of N-[3-(dimethylamino)propyl]-N-ethyl-6-(methylamino)pyridazine-3-carboxamide?
N-[3-(dimethylamino)propyl]-N-ethyl-6-(methylamino)pyridazine-3-carboxamide has a molecular weight of 265.36 g/mol, XLogP of 0.93, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)propyl]-N-ethyl-6-(methylamino)pyridazine-3-carboxamide is sourced from PubChem (CID 102996743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).