3-[1-(2-methoxyphenyl)sulfonylpyrrolidin-3-yl]oxypyridazine

C15H17N3O4S — CID 90638530

IUPAC3-[1-(2-methoxyphenyl)sulfonylpyrrolidin-3-yl]oxypyridazine
SMILESCOc1ccccc1S(=O)(=O)N1CCC(Oc2cccnn2)C1
InChIInChI=1S/C15H17N3O4S/c1-21-13-5-2-3-6-14(13)23(19,20)18-10-8-12(11-18)22-15-7-4-9-16-17-15/h2-7,9,12H,8,10-11H2,1H3
InChIKeyCNPIBVTUYACTLW-UHFFFAOYSA-N
MW335.38 g/mol
LogP1.33
Rot. Bonds5

About 3-[1-(2-methoxyphenyl)sulfonylpyrrolidin-3-yl]oxypyridazine

3-[1-(2-methoxyphenyl)sulfonylpyrrolidin-3-yl]oxypyridazine (PubChem CID 90638530) has the molecular formula C15H17N3O4S and a molecular weight of 335.38 g/mol. Its IUPAC name is 3-[1-(2-methoxyphenyl)sulfonylpyrrolidin-3-yl]oxypyridazine.

Molecular Properties

Compound Name3-[1-(2-methoxyphenyl)sulfonylpyrrolidin-3-yl]oxypyridazine
PubChem CID90638530
Molecular FormulaC15H17N3O4S
Molecular Weight335.38 g/mol
Exact Mass335.09
IUPAC Name3-[1-(2-methoxyphenyl)sulfonylpyrrolidin-3-yl]oxypyridazine
SMILESCOc1ccccc1S(=O)(=O)N1CCC(Oc2cccnn2)C1
InChIInChI=1S/C15H17N3O4S/c1-21-13-5-2-3-6-14(13)23(19,20)18-10-8-12(11-18)22-15-7-4-9-16-17-15/h2-7,9,12H,8,10-11H2,1H3
InChIKeyCNPIBVTUYACTLW-UHFFFAOYSA-N
XLogP1.33
TPSA81.62 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.38
LogP ≤ 51.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 3-[1-(2-methoxyphenyl)sulfonylpyrrolidin-3-yl]oxypyridazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[1-(2-methoxyphenyl)sulfonylpyrrolidin-3-yl]oxypyrazine
CID 90636391
3-[1-(5-chloro-2-methylphenyl)sulfonylpyrrolidin-3-yl]oxypyridazine
CID 90638526
3-[(3S)-1-cyclopropylsulfonylpyrrolidin-3-yl]oxypyridazine
CID 100624713
3-(1-propan-2-ylsulfonylpyrrolidin-3-yl)oxypyridazine
CID 90638533
3-(1-pyrrolidin-1-ylsulfonylpyrrolidin-3-yl)oxypyridazine
CID 90638570
3-[4-(2-methoxyphenyl)sulfonylpiperazin-1-yl]pyridazine
CID 121061006
3-(1-benzylsulfonylpyrrolidin-3-yl)oxypyridazine
CID 90638513
4-(3-pyridazin-3-yloxypyrrolidin-1-yl)sulfonylbenzonitrile
CID 91627303
3-[(3R)-1-(5-chlorothiophen-2-yl)sulfonylpyrrolidin-3-yl]oxypyridazine
CID 100624540
3-[1-(5-bromothiophen-2-yl)sulfonylpyrrolidin-3-yl]oxypyridazine
CID 90638544
3-[(3R)-1-(1-propan-2-ylimidazol-4-yl)sulfonylpyrrolidin-3-yl]oxypyridazine
CID 100625200
3-[1-(5-chloro-2-methylphenyl)sulfonylpiperidin-4-yl]oxypyridazine
CID 90559434

Frequently Asked Questions

What is the IUPAC name of 3-[1-(2-methoxyphenyl)sulfonylpyrrolidin-3-yl]oxypyridazine?
The IUPAC name of 3-[1-(2-methoxyphenyl)sulfonylpyrrolidin-3-yl]oxypyridazine (CID 90638530) is 3-[1-(2-methoxyphenyl)sulfonylpyrrolidin-3-yl]oxypyridazine.
What is the SMILES notation for 3-[1-(2-methoxyphenyl)sulfonylpyrrolidin-3-yl]oxypyridazine?
The canonical SMILES for 3-[1-(2-methoxyphenyl)sulfonylpyrrolidin-3-yl]oxypyridazine is COc1ccccc1S(=O)(=O)N1CCC(Oc2cccnn2)C1.
What is the InChIKey of 3-[1-(2-methoxyphenyl)sulfonylpyrrolidin-3-yl]oxypyridazine?
The InChIKey is CNPIBVTUYACTLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O4S/c1-21-13-5-2-3-6-14(13)23(19,20)18-10-8-12(11-18)22-15-7-4-9-16-17-15/h2-7,9,12H,8,10-11H2,1H3.
What are the key properties of 3-[1-(2-methoxyphenyl)sulfonylpyrrolidin-3-yl]oxypyridazine?
3-[1-(2-methoxyphenyl)sulfonylpyrrolidin-3-yl]oxypyridazine has a molecular weight of 335.38 g/mol, XLogP of 1.33, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(2-methoxyphenyl)sulfonylpyrrolidin-3-yl]oxypyridazine is sourced from PubChem (CID 90638530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).