N-(2-sulfamoylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide

C9H16F3N3O3S — CID 114908645

IUPACN-(2-sulfamoylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide
SMILESNS(=O)(=O)CCNC(=O)C1CCC(C(F)(F)F)CN1
InChIInChI=1S/C9H16F3N3O3S/c10-9(11,12)6-1-2-7(15-5-6)8(16)14-3-4-19(13,17)18/h6-7,15H,1-5H2,(H,14,16)(H2,13,17,18)
InChIKeyPDRJRFONAQYENK-UHFFFAOYSA-N
MW303.31 g/mol
LogP-0.68
Rot. Bonds4

About N-(2-sulfamoylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide

N-(2-sulfamoylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide (PubChem CID 114908645) has the molecular formula C9H16F3N3O3S and a molecular weight of 303.31 g/mol. Its IUPAC name is N-(2-sulfamoylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide.

Molecular Properties

Compound NameN-(2-sulfamoylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide
PubChem CID114908645
Molecular FormulaC9H16F3N3O3S
Molecular Weight303.31 g/mol
Exact Mass303.09
IUPAC NameN-(2-sulfamoylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide
SMILESNS(=O)(=O)CCNC(=O)C1CCC(C(F)(F)F)CN1
InChIInChI=1S/C9H16F3N3O3S/c10-9(11,12)6-1-2-7(15-5-6)8(16)14-3-4-19(13,17)18/h6-7,15H,1-5H2,(H,14,16)(H2,13,17,18)
InChIKeyPDRJRFONAQYENK-UHFFFAOYSA-N
XLogP-0.68
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.31
LogP ≤ 5-0.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-(2-sulfamoylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide 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-(2-sulfamoylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide?
The IUPAC name of N-(2-sulfamoylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide (CID 114908645) is N-(2-sulfamoylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide.
What is the SMILES notation for N-(2-sulfamoylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide?
The canonical SMILES for N-(2-sulfamoylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide is NS(=O)(=O)CCNC(=O)C1CCC(C(F)(F)F)CN1.
What is the InChIKey of N-(2-sulfamoylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide?
The InChIKey is PDRJRFONAQYENK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16F3N3O3S/c10-9(11,12)6-1-2-7(15-5-6)8(16)14-3-4-19(13,17)18/h6-7,15H,1-5H2,(H,14,16)(H2,13,17,18).
What are the key properties of N-(2-sulfamoylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide?
N-(2-sulfamoylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide has a molecular weight of 303.31 g/mol, XLogP of -0.68, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-sulfamoylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide is sourced from PubChem (CID 114908645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).