3,5-dimethyl-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-1,2-oxazole-4-sulfonamide

C15H21N5O3S — CID 113045115

IUPAC3,5-dimethyl-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-1,2-oxazole-4-sulfonamide
SMILESCc1noc(C)c1S(=O)(=O)Nc1ccc(N2CCCC(C)C2)nn1
InChIInChI=1S/C15H21N5O3S/c1-10-5-4-8-20(9-10)14-7-6-13(16-17-14)19-24(21,22)15-11(2)18-23-12(15)3/h6-7,10H,4-5,8-9H2,1-3H3,(H,16,19)
InChIKeyWYHMBFDCFOGINW-UHFFFAOYSA-N
MW351.43 g/mol
LogP2.12
Rot. Bonds4

About 3,5-dimethyl-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-1,2-oxazole-4-sulfonamide

3,5-dimethyl-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-1,2-oxazole-4-sulfonamide (PubChem CID 113045115) has the molecular formula C15H21N5O3S and a molecular weight of 351.43 g/mol. Its IUPAC name is 3,5-dimethyl-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-1,2-oxazole-4-sulfonamide.

Molecular Properties

Compound Name3,5-dimethyl-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-1,2-oxazole-4-sulfonamide
PubChem CID113045115
Molecular FormulaC15H21N5O3S
Molecular Weight351.43 g/mol
Exact Mass351.14
IUPAC Name3,5-dimethyl-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-1,2-oxazole-4-sulfonamide
SMILESCc1noc(C)c1S(=O)(=O)Nc1ccc(N2CCCC(C)C2)nn1
InChIInChI=1S/C15H21N5O3S/c1-10-5-4-8-20(9-10)14-7-6-13(16-17-14)19-24(21,22)15-11(2)18-23-12(15)3/h6-7,10H,4-5,8-9H2,1-3H3,(H,16,19)
InChIKeyWYHMBFDCFOGINW-UHFFFAOYSA-N
XLogP2.12
TPSA101.22 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.43
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 3,5-dimethyl-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-1,2-oxazole-4-sulfonamide 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-chloro-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]benzenesulfonamide
CID 113045122
N-[6-(cyclopentylamino)pyridazin-3-yl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide
CID 113038928
3,5-dimethyl-N-[6-(2-methyl-2,3-dihydroindol-1-yl)pyridazin-3-yl]-1,2-oxazole-4-sulfonamide
CID 113050740
N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]cyclopropanecarboxamide
CID 113045004
3,5-dimethyl-4-[4-(6-pyrrolidin-1-ylpyridazin-3-yl)piperazin-1-yl]sulfonyl-1,2-oxazole
CID 121053065
3,5-dimethyl-4-[4-(6-piperidin-1-ylpyridazin-3-yl)piperazin-1-yl]sulfonyl-1,2-oxazole
CID 121053093
2-(3-methylphenyl)-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]acetamide
CID 113045060
N-tert-butyl-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide
CID 109124840
4-chloro-N-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]benzenesulfonamide
CID 113039262
6-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazin-1-yl]-N-pyridin-4-ylpyridazin-3-amine
CID 42112005
ethyl 6-[(3S)-3-methylpiperidin-1-yl]pyridazine-3-carboxylate
CID 129495548
3-(dimethylsulfamoylamino)-6-(4-methylpiperidin-1-yl)pyridazine
CID 113039258

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-1,2-oxazole-4-sulfonamide?
The IUPAC name of 3,5-dimethyl-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-1,2-oxazole-4-sulfonamide (CID 113045115) is 3,5-dimethyl-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-1,2-oxazole-4-sulfonamide.
What is the SMILES notation for 3,5-dimethyl-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-1,2-oxazole-4-sulfonamide?
The canonical SMILES for 3,5-dimethyl-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-1,2-oxazole-4-sulfonamide is Cc1noc(C)c1S(=O)(=O)Nc1ccc(N2CCCC(C)C2)nn1.
What is the InChIKey of 3,5-dimethyl-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-1,2-oxazole-4-sulfonamide?
The InChIKey is WYHMBFDCFOGINW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O3S/c1-10-5-4-8-20(9-10)14-7-6-13(16-17-14)19-24(21,22)15-11(2)18-23-12(15)3/h6-7,10H,4-5,8-9H2,1-3H3,(H,16,19).
What are the key properties of 3,5-dimethyl-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-1,2-oxazole-4-sulfonamide?
3,5-dimethyl-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-1,2-oxazole-4-sulfonamide has a molecular weight of 351.43 g/mol, XLogP of 2.12, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]-1,2-oxazole-4-sulfonamide is sourced from PubChem (CID 113045115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).