2-(5-piperidin-1-ylsulfonylthiophen-2-yl)-N-(2,2,2-trifluoroethyl)acetamide

C13H17F3N2O3S2 — CID 51154153

IUPAC2-(5-piperidin-1-ylsulfonylthiophen-2-yl)-N-(2,2,2-trifluoroethyl)acetamide
SMILESO=C(Cc1ccc(S(=O)(=O)N2CCCCC2)s1)NCC(F)(F)F
InChIInChI=1S/C13H17F3N2O3S2/c14-13(15,16)9-17-11(19)8-10-4-5-12(22-10)23(20,21)18-6-2-1-3-7-18/h4-5H,1-3,6-9H2,(H,17,19)
InChIKeyQKMGYCFRQUKYIG-UHFFFAOYSA-N
MW370.42 g/mol
LogP2.14
Rot. Bonds5

About 2-(5-piperidin-1-ylsulfonylthiophen-2-yl)-N-(2,2,2-trifluoroethyl)acetamide

2-(5-piperidin-1-ylsulfonylthiophen-2-yl)-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 51154153) has the molecular formula C13H17F3N2O3S2 and a molecular weight of 370.42 g/mol. Its IUPAC name is 2-(5-piperidin-1-ylsulfonylthiophen-2-yl)-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-(5-piperidin-1-ylsulfonylthiophen-2-yl)-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID51154153
Molecular FormulaC13H17F3N2O3S2
Molecular Weight370.42 g/mol
Exact Mass370.06
IUPAC Name2-(5-piperidin-1-ylsulfonylthiophen-2-yl)-N-(2,2,2-trifluoroethyl)acetamide
SMILESO=C(Cc1ccc(S(=O)(=O)N2CCCCC2)s1)NCC(F)(F)F
InChIInChI=1S/C13H17F3N2O3S2/c14-13(15,16)9-17-11(19)8-10-4-5-12(22-10)23(20,21)18-6-2-1-3-7-18/h4-5H,1-3,6-9H2,(H,17,19)
InChIKeyQKMGYCFRQUKYIG-UHFFFAOYSA-N
XLogP2.14
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.42
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(5-piperidin-1-ylsulfonylthiophen-2-yl)-N-(2,2,2-trifluoroethyl)acetamide 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 2-(5-piperidin-1-ylsulfonylthiophen-2-yl)-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-(5-piperidin-1-ylsulfonylthiophen-2-yl)-N-(2,2,2-trifluoroethyl)acetamide (CID 51154153) is 2-(5-piperidin-1-ylsulfonylthiophen-2-yl)-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-(5-piperidin-1-ylsulfonylthiophen-2-yl)-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-(5-piperidin-1-ylsulfonylthiophen-2-yl)-N-(2,2,2-trifluoroethyl)acetamide is O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)s1)NCC(F)(F)F.
What is the InChIKey of 2-(5-piperidin-1-ylsulfonylthiophen-2-yl)-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is QKMGYCFRQUKYIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17F3N2O3S2/c14-13(15,16)9-17-11(19)8-10-4-5-12(22-10)23(20,21)18-6-2-1-3-7-18/h4-5H,1-3,6-9H2,(H,17,19).
What are the key properties of 2-(5-piperidin-1-ylsulfonylthiophen-2-yl)-N-(2,2,2-trifluoroethyl)acetamide?
2-(5-piperidin-1-ylsulfonylthiophen-2-yl)-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 370.42 g/mol, XLogP of 2.14, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-piperidin-1-ylsulfonylthiophen-2-yl)-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 51154153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).