N-[6-(2-ethylpiperidin-1-yl)pyridazin-3-yl]-2,5-dimethylbenzenesulfonamide

C19H26N4O2S — CID 113044977

IUPACN-[6-(2-ethylpiperidin-1-yl)pyridazin-3-yl]-2,5-dimethylbenzenesulfonamide
SMILESCCC1CCCCN1c1ccc(NS(=O)(=O)c2cc(C)ccc2C)nn1
InChIInChI=1S/C19H26N4O2S/c1-4-16-7-5-6-12-23(16)19-11-10-18(20-21-19)22-26(24,25)17-13-14(2)8-9-15(17)3/h8-11,13,16H,4-7,12H2,1-3H3,(H,20,22)
InChIKeyLFUWTBVZHIHFHW-UHFFFAOYSA-N
MW374.51 g/mol
LogP3.66
Rot. Bonds5

About N-[6-(2-ethylpiperidin-1-yl)pyridazin-3-yl]-2,5-dimethylbenzenesulfonamide

N-[6-(2-ethylpiperidin-1-yl)pyridazin-3-yl]-2,5-dimethylbenzenesulfonamide (PubChem CID 113044977) has the molecular formula C19H26N4O2S and a molecular weight of 374.51 g/mol. Its IUPAC name is N-[6-(2-ethylpiperidin-1-yl)pyridazin-3-yl]-2,5-dimethylbenzenesulfonamide.

Molecular Properties

Compound NameN-[6-(2-ethylpiperidin-1-yl)pyridazin-3-yl]-2,5-dimethylbenzenesulfonamide
PubChem CID113044977
Molecular FormulaC19H26N4O2S
Molecular Weight374.51 g/mol
Exact Mass374.18
IUPAC NameN-[6-(2-ethylpiperidin-1-yl)pyridazin-3-yl]-2,5-dimethylbenzenesulfonamide
SMILESCCC1CCCCN1c1ccc(NS(=O)(=O)c2cc(C)ccc2C)nn1
InChIInChI=1S/C19H26N4O2S/c1-4-16-7-5-6-12-23(16)19-11-10-18(20-21-19)22-26(24,25)17-13-14(2)8-9-15(17)3/h8-11,13,16H,4-7,12H2,1-3H3,(H,20,22)
InChIKeyLFUWTBVZHIHFHW-UHFFFAOYSA-N
XLogP3.66
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.51
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[6-(cyclopropylamino)pyridazin-3-yl]-2,5-dimethylbenzenesulfonamide
CID 113038129
ethyl 6-(2-ethylpiperidin-1-yl)pyridazine-3-carboxylate
CID 121206169
6-(2-ethylpiperidin-1-yl)-N-(5-methyl-1,2-oxazol-3-yl)pyridazine-3-carboxamide
CID 109125855
1-[6-(2-ethylpiperidin-1-yl)pyridazin-3-yl]-N-methylmethanamine
CID 62279015
N-[6-(2-ethylpiperidin-1-yl)pyridazin-3-yl]-1,3-benzodioxole-5-carboxamide
CID 113044943
3-(2-ethylpiperidin-1-yl)-6-methylsulfanylpyridazine
CID 133381363
N-(3,4-dimethylphenyl)-6-(2-ethylpiperidin-1-yl)-2-methylpyrimidin-4-amine
CID 112876470
N-[6-(2-ethylpiperidin-1-yl)-3-pyridinyl]-5-methylthiophene-2-sulfonamide
CID 113015578
N-[2-(dimethylamino)ethyl]-6-(2-ethylpiperidin-1-yl)pyridazine-3-carboxamide
CID 109115393
2-(2-chloroethyl)-1-(2,5-dimethylphenyl)sulfonylpiperidine
CID 63397489
5-chloro-N-[5-(2-ethylpiperidin-1-yl)-2-pyridinyl]thiophene-2-sulfonamide
CID 113030748
2,5-dimethyl-N-[6-(3-phenylpropylamino)pyridazin-3-yl]benzenesulfonamide
CID 113044146

Frequently Asked Questions

What is the IUPAC name of N-[6-(2-ethylpiperidin-1-yl)pyridazin-3-yl]-2,5-dimethylbenzenesulfonamide?
The IUPAC name of N-[6-(2-ethylpiperidin-1-yl)pyridazin-3-yl]-2,5-dimethylbenzenesulfonamide (CID 113044977) is N-[6-(2-ethylpiperidin-1-yl)pyridazin-3-yl]-2,5-dimethylbenzenesulfonamide.
What is the SMILES notation for N-[6-(2-ethylpiperidin-1-yl)pyridazin-3-yl]-2,5-dimethylbenzenesulfonamide?
The canonical SMILES for N-[6-(2-ethylpiperidin-1-yl)pyridazin-3-yl]-2,5-dimethylbenzenesulfonamide is CCC1CCCCN1c1ccc(NS(=O)(=O)c2cc(C)ccc2C)nn1.
What is the InChIKey of N-[6-(2-ethylpiperidin-1-yl)pyridazin-3-yl]-2,5-dimethylbenzenesulfonamide?
The InChIKey is LFUWTBVZHIHFHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O2S/c1-4-16-7-5-6-12-23(16)19-11-10-18(20-21-19)22-26(24,25)17-13-14(2)8-9-15(17)3/h8-11,13,16H,4-7,12H2,1-3H3,(H,20,22).
What are the key properties of N-[6-(2-ethylpiperidin-1-yl)pyridazin-3-yl]-2,5-dimethylbenzenesulfonamide?
N-[6-(2-ethylpiperidin-1-yl)pyridazin-3-yl]-2,5-dimethylbenzenesulfonamide has a molecular weight of 374.51 g/mol, XLogP of 3.66, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2-ethylpiperidin-1-yl)pyridazin-3-yl]-2,5-dimethylbenzenesulfonamide is sourced from PubChem (CID 113044977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).