2-thiophen-2-yl-1-[(2R)-2-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]ethanone

C16H15N3O2S2 — CID 124625670

IUPAC2-thiophen-2-yl-1-[(2R)-2-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]ethanone
SMILESO=C(Cc1cccs1)N1CCC[C@@H]1c1nc(-c2ccsc2)no1
InChIInChI=1S/C16H15N3O2S2/c20-14(9-12-3-2-7-23-12)19-6-1-4-13(19)16-17-15(18-21-16)11-5-8-22-10-11/h2-3,5,7-8,10,13H,1,4,6,9H2/t13-/m1/s1
InChIKeyTVOVMFZGNXUXLH-CYBMUJFWSA-N
MW345.45 g/mol
LogP3.77
Rot. Bonds4

About 2-thiophen-2-yl-1-[(2R)-2-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]ethanone

2-thiophen-2-yl-1-[(2R)-2-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]ethanone (PubChem CID 124625670) has the molecular formula C16H15N3O2S2 and a molecular weight of 345.45 g/mol. Its IUPAC name is 2-thiophen-2-yl-1-[(2R)-2-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]ethanone.

Molecular Properties

Compound Name2-thiophen-2-yl-1-[(2R)-2-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]ethanone
PubChem CID124625670
Molecular FormulaC16H15N3O2S2
Molecular Weight345.45 g/mol
Exact Mass345.06
IUPAC Name2-thiophen-2-yl-1-[(2R)-2-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]ethanone
SMILESO=C(Cc1cccs1)N1CCC[C@@H]1c1nc(-c2ccsc2)no1
InChIInChI=1S/C16H15N3O2S2/c20-14(9-12-3-2-7-23-12)19-6-1-4-13(19)16-17-15(18-21-16)11-5-8-22-10-11/h2-3,5,7-8,10,13H,1,4,6,9H2/t13-/m1/s1
InChIKeyTVOVMFZGNXUXLH-CYBMUJFWSA-N
XLogP3.77
TPSA59.23 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.45
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-thiophen-2-yl-1-[(2R)-2-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]ethanone 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

1-[(2S)-2-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]-2-thiophen-2-ylethanone
CID 95116467
1-[2-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]-2-thiophen-2-ylethanone
CID 90564177
1-[(2R)-2-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-2-thiophen-3-ylethanone
CID 95110773
1-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)pyrrolidin-1-yl]-2-thiophen-2-ylethanone
CID 71928854
1-[(2R)-2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]-2-thiophen-3-ylethanone
CID 95057503
2-phenyl-1-[(2R)-2-(3-phenyl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]ethanone
CID 124625631
2-(2-chlorophenyl)-1-[(2R)-2-(3-phenyl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]ethanone
CID 98042141
1-[3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]-2-thiophen-2-ylethanone
CID 87051841
1-[(2R)-2-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]-2-phenylethanone
CID 813005
N-(thiophen-2-ylmethyl)-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)azetidine-1-carboxamide
CID 121097329
1-[(2S)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propan-1-one
CID 27055411
1-[(2R)-2-(3-ethyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]-2-thiophen-2-ylethanone
CID 92731961

Frequently Asked Questions

What is the IUPAC name of 2-thiophen-2-yl-1-[(2R)-2-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]ethanone?
The IUPAC name of 2-thiophen-2-yl-1-[(2R)-2-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]ethanone (CID 124625670) is 2-thiophen-2-yl-1-[(2R)-2-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]ethanone.
What is the SMILES notation for 2-thiophen-2-yl-1-[(2R)-2-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]ethanone?
The canonical SMILES for 2-thiophen-2-yl-1-[(2R)-2-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]ethanone is O=C(Cc1cccs1)N1CCC[C@@H]1c1nc(-c2ccsc2)no1.
What is the InChIKey of 2-thiophen-2-yl-1-[(2R)-2-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]ethanone?
The InChIKey is TVOVMFZGNXUXLH-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H15N3O2S2/c20-14(9-12-3-2-7-23-12)19-6-1-4-13(19)16-17-15(18-21-16)11-5-8-22-10-11/h2-3,5,7-8,10,13H,1,4,6,9H2/t13-/m1/s1.
What are the key properties of 2-thiophen-2-yl-1-[(2R)-2-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]ethanone?
2-thiophen-2-yl-1-[(2R)-2-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]ethanone has a molecular weight of 345.45 g/mol, XLogP of 3.77, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-thiophen-2-yl-1-[(2R)-2-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]ethanone is sourced from PubChem (CID 124625670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).