N-methyl-N-(1-pyridin-2-ylpiperidin-3-yl)methanesulfonamide

C12H19N3O2S — CID 73439635

IUPACN-methyl-N-(1-pyridin-2-ylpiperidin-3-yl)methanesulfonamide
SMILESCN(C1CCCN(c2ccccn2)C1)S(C)(=O)=O
InChIInChI=1S/C12H19N3O2S/c1-14(18(2,16)17)11-6-5-9-15(10-11)12-7-3-4-8-13-12/h3-4,7-8,11H,5-6,9-10H2,1-2H3
InChIKeyDLZOCEGZVNRNJB-UHFFFAOYSA-N
MW269.37 g/mol
LogP0.94
Rot. Bonds3

About N-methyl-N-(1-pyridin-2-ylpiperidin-3-yl)methanesulfonamide

N-methyl-N-(1-pyridin-2-ylpiperidin-3-yl)methanesulfonamide (PubChem CID 73439635) has the molecular formula C12H19N3O2S and a molecular weight of 269.37 g/mol. Its IUPAC name is N-methyl-N-(1-pyridin-2-ylpiperidin-3-yl)methanesulfonamide.

Molecular Properties

Compound NameN-methyl-N-(1-pyridin-2-ylpiperidin-3-yl)methanesulfonamide
PubChem CID73439635
Molecular FormulaC12H19N3O2S
Molecular Weight269.37 g/mol
Exact Mass269.12
IUPAC NameN-methyl-N-(1-pyridin-2-ylpiperidin-3-yl)methanesulfonamide
SMILESCN(C1CCCN(c2ccccn2)C1)S(C)(=O)=O
InChIInChI=1S/C12H19N3O2S/c1-14(18(2,16)17)11-6-5-9-15(10-11)12-7-3-4-8-13-12/h3-4,7-8,11H,5-6,9-10H2,1-2H3
InChIKeyDLZOCEGZVNRNJB-UHFFFAOYSA-N
XLogP0.94
TPSA53.51 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 50.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-methyl-N-(1-pyridin-2-ylpiperidin-3-yl)methanesulfonamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-pyridin-2-ylpiperidin-3-yl)methanesulfonamide?
The IUPAC name of N-methyl-N-(1-pyridin-2-ylpiperidin-3-yl)methanesulfonamide (CID 73439635) is N-methyl-N-(1-pyridin-2-ylpiperidin-3-yl)methanesulfonamide.
What is the SMILES notation for N-methyl-N-(1-pyridin-2-ylpiperidin-3-yl)methanesulfonamide?
The canonical SMILES for N-methyl-N-(1-pyridin-2-ylpiperidin-3-yl)methanesulfonamide is CN(C1CCCN(c2ccccn2)C1)S(C)(=O)=O.
What is the InChIKey of N-methyl-N-(1-pyridin-2-ylpiperidin-3-yl)methanesulfonamide?
The InChIKey is DLZOCEGZVNRNJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2S/c1-14(18(2,16)17)11-6-5-9-15(10-11)12-7-3-4-8-13-12/h3-4,7-8,11H,5-6,9-10H2,1-2H3.
What are the key properties of N-methyl-N-(1-pyridin-2-ylpiperidin-3-yl)methanesulfonamide?
N-methyl-N-(1-pyridin-2-ylpiperidin-3-yl)methanesulfonamide has a molecular weight of 269.37 g/mol, XLogP of 0.94, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-pyridin-2-ylpiperidin-3-yl)methanesulfonamide is sourced from PubChem (CID 73439635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).