3-[3-(dimethylamino)propylamino]-6-(dimethylsulfamoylamino)pyridazine

C11H22N6O2S — CID 113040165

IUPAC3-[3-(dimethylamino)propylamino]-6-(dimethylsulfamoylamino)pyridazine
SMILESCN(C)CCCNc1ccc(NS(=O)(=O)N(C)C)nn1
InChIInChI=1S/C11H22N6O2S/c1-16(2)9-5-8-12-10-6-7-11(14-13-10)15-20(18,19)17(3)4/h6-7H,5,8-9H2,1-4H3,(H,12,13)(H,14,15)
InChIKeyUOHFVFJNNOPCNC-UHFFFAOYSA-N
MW302.40 g/mol
LogP0.06
Rot. Bonds8

About 3-[3-(dimethylamino)propylamino]-6-(dimethylsulfamoylamino)pyridazine

3-[3-(dimethylamino)propylamino]-6-(dimethylsulfamoylamino)pyridazine (PubChem CID 113040165) has the molecular formula C11H22N6O2S and a molecular weight of 302.40 g/mol. Its IUPAC name is 3-[3-(dimethylamino)propylamino]-6-(dimethylsulfamoylamino)pyridazine.

Molecular Properties

Compound Name3-[3-(dimethylamino)propylamino]-6-(dimethylsulfamoylamino)pyridazine
PubChem CID113040165
Molecular FormulaC11H22N6O2S
Molecular Weight302.40 g/mol
Exact Mass302.15
IUPAC Name3-[3-(dimethylamino)propylamino]-6-(dimethylsulfamoylamino)pyridazine
SMILESCN(C)CCCNc1ccc(NS(=O)(=O)N(C)C)nn1
InChIInChI=1S/C11H22N6O2S/c1-16(2)9-5-8-12-10-6-7-11(14-13-10)15-20(18,19)17(3)4/h6-7H,5,8-9H2,1-4H3,(H,12,13)(H,14,15)
InChIKeyUOHFVFJNNOPCNC-UHFFFAOYSA-N
XLogP0.06
TPSA90.46 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.40
LogP ≤ 50.06
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-[6-[3-(dimethylamino)propylamino]pyridazin-3-yl]-4-ethoxybenzenesulfonamide
CID 113040198
N-[6-[3-(dimethylamino)propylamino]pyridazin-3-yl]-4-methoxybenzenesulfonamide
CID 16941927
N-[3-(dimethylamino)propyl]-6-[3-(dimethylamino)propylamino]pyridazine-3-carboxamide
CID 109115782
methyl 6-[3-(dimethylamino)propylamino]pyridazine-3-carboxylate
CID 60792902
5-[2-(dimethylamino)ethylamino]-2-(dimethylsulfamoylamino)pyridine
CID 113025561
3-(dimethylsulfamoylamino)-6-[(4-methylphenyl)methylamino]pyridazine
CID 113041130
N-[6-[2-(dimethylamino)ethylamino]pyridazin-3-yl]-2-methylbenzenesulfonamide
CID 113040001
N-[6-[3-(dimethylamino)propylamino]pyridazin-3-yl]-2-(4-methylphenyl)acetamide
CID 113040148
6-[3-(dimethylamino)propylamino]-N-(2-methylpropyl)pyridazine-3-carboxamide
CID 109111167
N-[6-(pentylamino)pyridazin-3-yl]methanesulfonamide
CID 113044700
3-(dimethylsulfamoylamino)-6-[(4-methoxyphenyl)methylamino]pyridazine
CID 113041805
6-[4-(dimethylamino)butylamino]-N-methylpyridazine-3-carboxamide
CID 79207291

Frequently Asked Questions

What is the IUPAC name of 3-[3-(dimethylamino)propylamino]-6-(dimethylsulfamoylamino)pyridazine?
The IUPAC name of 3-[3-(dimethylamino)propylamino]-6-(dimethylsulfamoylamino)pyridazine (CID 113040165) is 3-[3-(dimethylamino)propylamino]-6-(dimethylsulfamoylamino)pyridazine.
What is the SMILES notation for 3-[3-(dimethylamino)propylamino]-6-(dimethylsulfamoylamino)pyridazine?
The canonical SMILES for 3-[3-(dimethylamino)propylamino]-6-(dimethylsulfamoylamino)pyridazine is CN(C)CCCNc1ccc(NS(=O)(=O)N(C)C)nn1.
What is the InChIKey of 3-[3-(dimethylamino)propylamino]-6-(dimethylsulfamoylamino)pyridazine?
The InChIKey is UOHFVFJNNOPCNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N6O2S/c1-16(2)9-5-8-12-10-6-7-11(14-13-10)15-20(18,19)17(3)4/h6-7H,5,8-9H2,1-4H3,(H,12,13)(H,14,15).
What are the key properties of 3-[3-(dimethylamino)propylamino]-6-(dimethylsulfamoylamino)pyridazine?
3-[3-(dimethylamino)propylamino]-6-(dimethylsulfamoylamino)pyridazine has a molecular weight of 302.40 g/mol, XLogP of 0.06, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(dimethylamino)propylamino]-6-(dimethylsulfamoylamino)pyridazine is sourced from PubChem (CID 113040165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).