N-methyl-5-methylidenepiperidine-3-sulfonamide

C7H14N2O2S — CID 123521186

IUPACN-methyl-5-methylidenepiperidine-3-sulfonamide
SMILESC=C1CNCC(S(=O)(=O)NC)C1
InChIInChI=1S/C7H14N2O2S/c1-6-3-7(5-9-4-6)12(10,11)8-2/h7-9H,1,3-5H2,2H3
InChIKeyFEGCLKUHSWJCRN-UHFFFAOYSA-N
MW190.27 g/mol
LogP-0.55
Rot. Bonds2

About N-methyl-5-methylidenepiperidine-3-sulfonamide

N-methyl-5-methylidenepiperidine-3-sulfonamide (PubChem CID 123521186) has the molecular formula C7H14N2O2S and a molecular weight of 190.27 g/mol. Its IUPAC name is N-methyl-5-methylidenepiperidine-3-sulfonamide.

Molecular Properties

Compound NameN-methyl-5-methylidenepiperidine-3-sulfonamide
PubChem CID123521186
Molecular FormulaC7H14N2O2S
Molecular Weight190.27 g/mol
Exact Mass190.08
IUPAC NameN-methyl-5-methylidenepiperidine-3-sulfonamide
SMILESC=C1CNCC(S(=O)(=O)NC)C1
InChIInChI=1S/C7H14N2O2S/c1-6-3-7(5-9-4-6)12(10,11)8-2/h7-9H,1,3-5H2,2H3
InChIKeyFEGCLKUHSWJCRN-UHFFFAOYSA-N
XLogP-0.55
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.27
LogP ≤ 5-0.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze N-methyl-5-methylidenepiperidine-3-sulfonamide 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-5-methylidenepiperidine-3-sulfonamide?
The IUPAC name of N-methyl-5-methylidenepiperidine-3-sulfonamide (CID 123521186) is N-methyl-5-methylidenepiperidine-3-sulfonamide.
What is the SMILES notation for N-methyl-5-methylidenepiperidine-3-sulfonamide?
The canonical SMILES for N-methyl-5-methylidenepiperidine-3-sulfonamide is C=C1CNCC(S(=O)(=O)NC)C1.
What is the InChIKey of N-methyl-5-methylidenepiperidine-3-sulfonamide?
The InChIKey is FEGCLKUHSWJCRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O2S/c1-6-3-7(5-9-4-6)12(10,11)8-2/h7-9H,1,3-5H2,2H3.
What are the key properties of N-methyl-5-methylidenepiperidine-3-sulfonamide?
N-methyl-5-methylidenepiperidine-3-sulfonamide has a molecular weight of 190.27 g/mol, XLogP of -0.55, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-methylidenepiperidine-3-sulfonamide is sourced from PubChem (CID 123521186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).