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

C15H28N6O — CID 109115782

IUPACN-[3-(dimethylamino)propyl]-6-[3-(dimethylamino)propylamino]pyridazine-3-carboxamide
SMILESCN(C)CCCNC(=O)c1ccc(NCCCN(C)C)nn1
InChIInChI=1S/C15H28N6O/c1-20(2)11-5-9-16-14-8-7-13(18-19-14)15(22)17-10-6-12-21(3)4/h7-8H,5-6,9-12H2,1-4H3,(H,16,19)(H,17,22)
InChIKeyKYVHYOMZEQCCOT-UHFFFAOYSA-N
MW308.43 g/mol
LogP0.52
Rot. Bonds10

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

N-[3-(dimethylamino)propyl]-6-[3-(dimethylamino)propylamino]pyridazine-3-carboxamide (PubChem CID 109115782) has the molecular formula C15H28N6O and a molecular weight of 308.43 g/mol. Its IUPAC name is N-[3-(dimethylamino)propyl]-6-[3-(dimethylamino)propylamino]pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)propyl]-6-[3-(dimethylamino)propylamino]pyridazine-3-carboxamide
PubChem CID109115782
Molecular FormulaC15H28N6O
Molecular Weight308.43 g/mol
Exact Mass308.23
IUPAC NameN-[3-(dimethylamino)propyl]-6-[3-(dimethylamino)propylamino]pyridazine-3-carboxamide
SMILESCN(C)CCCNC(=O)c1ccc(NCCCN(C)C)nn1
InChIInChI=1S/C15H28N6O/c1-20(2)11-5-9-16-14-8-7-13(18-19-14)15(22)17-10-6-12-21(3)4/h7-8H,5-6,9-12H2,1-4H3,(H,16,19)(H,17,22)
InChIKeyKYVHYOMZEQCCOT-UHFFFAOYSA-N
XLogP0.52
TPSA73.39 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.43
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(dimethylamino)ethyl]-6-[2-(dimethylamino)ethylamino]pyridazine-3-carboxamide
CID 109115146
N-[3-(dimethylamino)propyl]-6-(3-methylbutylamino)pyridazine-3-carboxamide
CID 109116007
6-(butylamino)-N-[2-(dimethylamino)ethyl]pyridazine-3-carboxamide
CID 109110589
6-[3-(dimethylamino)propylamino]-N-(2-methylpropyl)pyridazine-3-carboxamide
CID 109111167
6-[4-(dimethylamino)butylamino]-N-methylpyridazine-3-carboxamide
CID 79207291
methyl 6-[3-(dimethylamino)propylamino]pyridazine-3-carboxylate
CID 60792902
N-[3-(dimethylamino)propyl]-6-(2-morpholin-4-ylethylamino)pyridazine-3-carboxamide
CID 109115508
N-[3-(dimethylamino)propyl]-6-methylpyridazine-3-carboxamide
CID 110705198
6-[(2-chlorophenyl)methylamino]-N-[3-(dimethylamino)propyl]pyridazine-3-carboxamide
CID 109115965
N-[(2-chlorophenyl)methyl]-6-[3-(dimethylamino)propylamino]pyridazine-3-carboxamide
CID 109115796
6-[2-(dimethylamino)ethylamino]-N-(2-methylpropyl)pyridazine-3-carboxamide
CID 109111165
N-[3-(dimethylamino)propyl]-6-(2-fluoroanilino)pyridazine-3-carboxamide
CID 109116042

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)propyl]-6-[3-(dimethylamino)propylamino]pyridazine-3-carboxamide?
The IUPAC name of N-[3-(dimethylamino)propyl]-6-[3-(dimethylamino)propylamino]pyridazine-3-carboxamide (CID 109115782) is N-[3-(dimethylamino)propyl]-6-[3-(dimethylamino)propylamino]pyridazine-3-carboxamide.
What is the SMILES notation for N-[3-(dimethylamino)propyl]-6-[3-(dimethylamino)propylamino]pyridazine-3-carboxamide?
The canonical SMILES for N-[3-(dimethylamino)propyl]-6-[3-(dimethylamino)propylamino]pyridazine-3-carboxamide is CN(C)CCCNC(=O)c1ccc(NCCCN(C)C)nn1.
What is the InChIKey of N-[3-(dimethylamino)propyl]-6-[3-(dimethylamino)propylamino]pyridazine-3-carboxamide?
The InChIKey is KYVHYOMZEQCCOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N6O/c1-20(2)11-5-9-16-14-8-7-13(18-19-14)15(22)17-10-6-12-21(3)4/h7-8H,5-6,9-12H2,1-4H3,(H,16,19)(H,17,22).
What are the key properties of N-[3-(dimethylamino)propyl]-6-[3-(dimethylamino)propylamino]pyridazine-3-carboxamide?
N-[3-(dimethylamino)propyl]-6-[3-(dimethylamino)propylamino]pyridazine-3-carboxamide has a molecular weight of 308.43 g/mol, XLogP of 0.52, 10 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)propyl]-6-[3-(dimethylamino)propylamino]pyridazine-3-carboxamide is sourced from PubChem (CID 109115782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).