N-methyl-2-piperidin-3-yloxybenzenesulfonamide

C12H18N2O3S — CID 62348851

IUPACN-methyl-2-piperidin-3-yloxybenzenesulfonamide
SMILESCNS(=O)(=O)c1ccccc1OC1CCCNC1
InChIInChI=1S/C12H18N2O3S/c1-13-18(15,16)12-7-3-2-6-11(12)17-10-5-4-8-14-9-10/h2-3,6-7,10,13-14H,4-5,8-9H2,1H3
InChIKeyOEZZEORRPDXSBU-UHFFFAOYSA-N
MW270.35 g/mol
LogP0.73
Rot. Bonds4

About N-methyl-2-piperidin-3-yloxybenzenesulfonamide

N-methyl-2-piperidin-3-yloxybenzenesulfonamide (PubChem CID 62348851) has the molecular formula C12H18N2O3S and a molecular weight of 270.35 g/mol. Its IUPAC name is N-methyl-2-piperidin-3-yloxybenzenesulfonamide.

Molecular Properties

Compound NameN-methyl-2-piperidin-3-yloxybenzenesulfonamide
PubChem CID62348851
Molecular FormulaC12H18N2O3S
Molecular Weight270.35 g/mol
Exact Mass270.10
IUPAC NameN-methyl-2-piperidin-3-yloxybenzenesulfonamide
SMILESCNS(=O)(=O)c1ccccc1OC1CCCNC1
InChIInChI=1S/C12H18N2O3S/c1-13-18(15,16)12-7-3-2-6-11(12)17-10-5-4-8-14-9-10/h2-3,6-7,10,13-14H,4-5,8-9H2,1H3
InChIKeyOEZZEORRPDXSBU-UHFFFAOYSA-N
XLogP0.73
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.35
LogP ≤ 50.73
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-3-yloxybenzenesulfonamide?
The IUPAC name of N-methyl-2-piperidin-3-yloxybenzenesulfonamide (CID 62348851) is N-methyl-2-piperidin-3-yloxybenzenesulfonamide.
What is the SMILES notation for N-methyl-2-piperidin-3-yloxybenzenesulfonamide?
The canonical SMILES for N-methyl-2-piperidin-3-yloxybenzenesulfonamide is CNS(=O)(=O)c1ccccc1OC1CCCNC1.
What is the InChIKey of N-methyl-2-piperidin-3-yloxybenzenesulfonamide?
The InChIKey is OEZZEORRPDXSBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3S/c1-13-18(15,16)12-7-3-2-6-11(12)17-10-5-4-8-14-9-10/h2-3,6-7,10,13-14H,4-5,8-9H2,1H3.
What are the key properties of N-methyl-2-piperidin-3-yloxybenzenesulfonamide?
N-methyl-2-piperidin-3-yloxybenzenesulfonamide has a molecular weight of 270.35 g/mol, XLogP of 0.73, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-piperidin-3-yloxybenzenesulfonamide is sourced from PubChem (CID 62348851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).