4-(aminomethyl)-N-thiophen-3-ylpiperidine-1-sulfonamide

C10H17N3O2S2 — CID 106069875

IUPAC4-(aminomethyl)-N-thiophen-3-ylpiperidine-1-sulfonamide
SMILESNCC1CCN(S(=O)(=O)Nc2ccsc2)CC1
InChIInChI=1S/C10H17N3O2S2/c11-7-9-1-4-13(5-2-9)17(14,15)12-10-3-6-16-8-10/h3,6,8-9,12H,1-2,4-5,7,11H2
InChIKeyXEQCYBXRUVLAPI-UHFFFAOYSA-N
MW275.40 g/mol
LogP1.08
Rot. Bonds4

About 4-(aminomethyl)-N-thiophen-3-ylpiperidine-1-sulfonamide

4-(aminomethyl)-N-thiophen-3-ylpiperidine-1-sulfonamide (PubChem CID 106069875) has the molecular formula C10H17N3O2S2 and a molecular weight of 275.40 g/mol. Its IUPAC name is 4-(aminomethyl)-N-thiophen-3-ylpiperidine-1-sulfonamide.

Molecular Properties

Compound Name4-(aminomethyl)-N-thiophen-3-ylpiperidine-1-sulfonamide
PubChem CID106069875
Molecular FormulaC10H17N3O2S2
Molecular Weight275.40 g/mol
Exact Mass275.08
IUPAC Name4-(aminomethyl)-N-thiophen-3-ylpiperidine-1-sulfonamide
SMILESNCC1CCN(S(=O)(=O)Nc2ccsc2)CC1
InChIInChI=1S/C10H17N3O2S2/c11-7-9-1-4-13(5-2-9)17(14,15)12-10-3-6-16-8-10/h3,6,8-9,12H,1-2,4-5,7,11H2
InChIKeyXEQCYBXRUVLAPI-UHFFFAOYSA-N
XLogP1.08
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-(aminomethyl)-N-thiophen-3-ylpiperidine-1-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-(aminomethyl)-N-thiophen-3-ylpiperidine-1-sulfonamide
CID 114141613
4-(aminomethyl)-N-(2-methyl-4-pyridinyl)piperidine-1-sulfonamide
CID 106071212
4-(aminomethyl)-N-(1,3-benzodioxol-5-yl)piperidine-1-sulfonamide
CID 106023610
4-(aminomethyl)-N-(3-bromo-4-fluorophenyl)piperidine-1-sulfonamide
CID 106078254
4-(aminomethyl)-N-(5-methyl-3-pyridinyl)piperidine-1-sulfonamide
CID 106087973
4-(aminomethyl)-N-(2,5-dichlorophenyl)piperidine-1-sulfonamide
CID 106037007
4-(aminomethyl)-N-(6-methyl-2-pyridinyl)piperidine-1-sulfonamide
CID 106086848
4-(aminomethyl)-N-(2-fluoro-6-methylphenyl)piperidine-1-sulfonamide
CID 106083694
4-(aminomethyl)-N-(3-bromo-2-pyridinyl)piperidine-1-sulfonamide
CID 106062105
4-(aminomethyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine-1-sulfonamide
CID 106082713
4-(aminomethyl)-N-(4-bromo-2,5-difluorophenyl)piperidine-1-sulfonamide
CID 106088800
4-(aminomethyl)-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)piperidine-1-sulfonamide
CID 106053320

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-N-thiophen-3-ylpiperidine-1-sulfonamide?
The IUPAC name of 4-(aminomethyl)-N-thiophen-3-ylpiperidine-1-sulfonamide (CID 106069875) is 4-(aminomethyl)-N-thiophen-3-ylpiperidine-1-sulfonamide.
What is the SMILES notation for 4-(aminomethyl)-N-thiophen-3-ylpiperidine-1-sulfonamide?
The canonical SMILES for 4-(aminomethyl)-N-thiophen-3-ylpiperidine-1-sulfonamide is NCC1CCN(S(=O)(=O)Nc2ccsc2)CC1.
What is the InChIKey of 4-(aminomethyl)-N-thiophen-3-ylpiperidine-1-sulfonamide?
The InChIKey is XEQCYBXRUVLAPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2S2/c11-7-9-1-4-13(5-2-9)17(14,15)12-10-3-6-16-8-10/h3,6,8-9,12H,1-2,4-5,7,11H2.
What are the key properties of 4-(aminomethyl)-N-thiophen-3-ylpiperidine-1-sulfonamide?
4-(aminomethyl)-N-thiophen-3-ylpiperidine-1-sulfonamide has a molecular weight of 275.40 g/mol, XLogP of 1.08, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-N-thiophen-3-ylpiperidine-1-sulfonamide is sourced from PubChem (CID 106069875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).