N-methyl-2-(piperidin-2-ylmethoxy)benzenesulfonamide

C13H20N2O3S — CID 62349156

IUPACN-methyl-2-(piperidin-2-ylmethoxy)benzenesulfonamide
SMILESCNS(=O)(=O)c1ccccc1OCC1CCCCN1
InChIInChI=1S/C13H20N2O3S/c1-14-19(16,17)13-8-3-2-7-12(13)18-10-11-6-4-5-9-15-11/h2-3,7-8,11,14-15H,4-6,9-10H2,1H3
InChIKeyVIPWMFAEDCWGKP-UHFFFAOYSA-N
MW284.38 g/mol
LogP1.12
Rot. Bonds5

About N-methyl-2-(piperidin-2-ylmethoxy)benzenesulfonamide

N-methyl-2-(piperidin-2-ylmethoxy)benzenesulfonamide (PubChem CID 62349156) has the molecular formula C13H20N2O3S and a molecular weight of 284.38 g/mol. Its IUPAC name is N-methyl-2-(piperidin-2-ylmethoxy)benzenesulfonamide.

Molecular Properties

Compound NameN-methyl-2-(piperidin-2-ylmethoxy)benzenesulfonamide
PubChem CID62349156
Molecular FormulaC13H20N2O3S
Molecular Weight284.38 g/mol
Exact Mass284.12
IUPAC NameN-methyl-2-(piperidin-2-ylmethoxy)benzenesulfonamide
SMILESCNS(=O)(=O)c1ccccc1OCC1CCCCN1
InChIInChI=1S/C13H20N2O3S/c1-14-19(16,17)13-8-3-2-7-12(13)18-10-11-6-4-5-9-15-11/h2-3,7-8,11,14-15H,4-6,9-10H2,1H3
InChIKeyVIPWMFAEDCWGKP-UHFFFAOYSA-N
XLogP1.12
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(piperidin-2-ylmethoxy)benzenesulfonamide?
The IUPAC name of N-methyl-2-(piperidin-2-ylmethoxy)benzenesulfonamide (CID 62349156) is N-methyl-2-(piperidin-2-ylmethoxy)benzenesulfonamide.
What is the SMILES notation for N-methyl-2-(piperidin-2-ylmethoxy)benzenesulfonamide?
The canonical SMILES for N-methyl-2-(piperidin-2-ylmethoxy)benzenesulfonamide is CNS(=O)(=O)c1ccccc1OCC1CCCCN1.
What is the InChIKey of N-methyl-2-(piperidin-2-ylmethoxy)benzenesulfonamide?
The InChIKey is VIPWMFAEDCWGKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O3S/c1-14-19(16,17)13-8-3-2-7-12(13)18-10-11-6-4-5-9-15-11/h2-3,7-8,11,14-15H,4-6,9-10H2,1H3.
What are the key properties of N-methyl-2-(piperidin-2-ylmethoxy)benzenesulfonamide?
N-methyl-2-(piperidin-2-ylmethoxy)benzenesulfonamide has a molecular weight of 284.38 g/mol, XLogP of 1.12, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(piperidin-2-ylmethoxy)benzenesulfonamide is sourced from PubChem (CID 62349156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).