3-(dimethylsulfamoylamino)-6-piperidin-1-ylpyridazine

C11H19N5O2S — CID 113039016

IUPAC3-(dimethylsulfamoylamino)-6-piperidin-1-ylpyridazine
SMILESCN(C)S(=O)(=O)Nc1ccc(N2CCCCC2)nn1
InChIInChI=1S/C11H19N5O2S/c1-15(2)19(17,18)14-10-6-7-11(13-12-10)16-8-4-3-5-9-16/h6-7H,3-5,8-9H2,1-2H3,(H,12,14)
InChIKeyKXEBSEMDRXPCNP-UHFFFAOYSA-N
MW285.37 g/mol
LogP0.69
Rot. Bonds4

About 3-(dimethylsulfamoylamino)-6-piperidin-1-ylpyridazine

3-(dimethylsulfamoylamino)-6-piperidin-1-ylpyridazine (PubChem CID 113039016) has the molecular formula C11H19N5O2S and a molecular weight of 285.37 g/mol. Its IUPAC name is 3-(dimethylsulfamoylamino)-6-piperidin-1-ylpyridazine.

Molecular Properties

Compound Name3-(dimethylsulfamoylamino)-6-piperidin-1-ylpyridazine
PubChem CID113039016
Molecular FormulaC11H19N5O2S
Molecular Weight285.37 g/mol
Exact Mass285.13
IUPAC Name3-(dimethylsulfamoylamino)-6-piperidin-1-ylpyridazine
SMILESCN(C)S(=O)(=O)Nc1ccc(N2CCCCC2)nn1
InChIInChI=1S/C11H19N5O2S/c1-15(2)19(17,18)14-10-6-7-11(13-12-10)16-8-4-3-5-9-16/h6-7H,3-5,8-9H2,1-2H3,(H,12,14)
InChIKeyKXEBSEMDRXPCNP-UHFFFAOYSA-N
XLogP0.69
TPSA78.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.37
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(dimethylsulfamoylamino)-6-(4-methylpiperidin-1-yl)pyridazine
CID 113039258
3-(dimethylsulfamoylamino)-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazine
CID 113043949
3-(dimethylsulfamoylamino)-6-(4-pyridin-2-ylpiperazin-1-yl)pyridazine
CID 113043895
3-(dimethylsulfamoylamino)-6-[4-(2-fluorophenyl)piperazin-1-yl]pyridazine
CID 113043785
N-(6-pyrrolidin-1-ylpyridazin-3-yl)propane-1-sulfonamide
CID 113038761
N-(6-piperidin-1-ylpyridazin-3-yl)butane-1-sulfonamide
CID 113039015
2-chloro-N-(6-piperidin-1-ylpyridazin-3-yl)benzenesulfonamide
CID 113039063
N-[6-(azepan-1-yl)pyridazin-3-yl]-3,4-dimethoxybenzenesulfonamide
CID 113045402
4-ethoxy-N-(6-pyrrolidin-1-ylpyridazin-3-yl)benzenesulfonamide
CID 113038808
2-(dimethylsulfamoylamino)-5-pyrrolidin-1-ylpyridine
CID 113024377
N-[6-(azepan-1-yl)pyridazin-3-yl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
CID 113045406
1-[4-(dimethylsulfamoylamino)phenyl]piperidine
CID 110756594

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylsulfamoylamino)-6-piperidin-1-ylpyridazine?
The IUPAC name of 3-(dimethylsulfamoylamino)-6-piperidin-1-ylpyridazine (CID 113039016) is 3-(dimethylsulfamoylamino)-6-piperidin-1-ylpyridazine.
What is the SMILES notation for 3-(dimethylsulfamoylamino)-6-piperidin-1-ylpyridazine?
The canonical SMILES for 3-(dimethylsulfamoylamino)-6-piperidin-1-ylpyridazine is CN(C)S(=O)(=O)Nc1ccc(N2CCCCC2)nn1.
What is the InChIKey of 3-(dimethylsulfamoylamino)-6-piperidin-1-ylpyridazine?
The InChIKey is KXEBSEMDRXPCNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O2S/c1-15(2)19(17,18)14-10-6-7-11(13-12-10)16-8-4-3-5-9-16/h6-7H,3-5,8-9H2,1-2H3,(H,12,14).
What are the key properties of 3-(dimethylsulfamoylamino)-6-piperidin-1-ylpyridazine?
3-(dimethylsulfamoylamino)-6-piperidin-1-ylpyridazine has a molecular weight of 285.37 g/mol, XLogP of 0.69, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylsulfamoylamino)-6-piperidin-1-ylpyridazine is sourced from PubChem (CID 113039016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).