3-(1-thiophen-2-ylpropan-2-ylamino)pyrrolidine-2,5-dione

C11H14N2O2S — CID 63291448

IUPAC3-(1-thiophen-2-ylpropan-2-ylamino)pyrrolidine-2,5-dione
SMILESCC(Cc1cccs1)NC1CC(=O)NC1=O
InChIInChI=1S/C11H14N2O2S/c1-7(5-8-3-2-4-16-8)12-9-6-10(14)13-11(9)15/h2-4,7,9,12H,5-6H2,1H3,(H,13,14,15)
InChIKeyAKQDHJZELIFHBG-UHFFFAOYSA-N
MW238.31 g/mol
LogP0.68
Rot. Bonds4

About 3-(1-thiophen-2-ylpropan-2-ylamino)pyrrolidine-2,5-dione

3-(1-thiophen-2-ylpropan-2-ylamino)pyrrolidine-2,5-dione (PubChem CID 63291448) has the molecular formula C11H14N2O2S and a molecular weight of 238.31 g/mol. Its IUPAC name is 3-(1-thiophen-2-ylpropan-2-ylamino)pyrrolidine-2,5-dione.

Molecular Properties

Compound Name3-(1-thiophen-2-ylpropan-2-ylamino)pyrrolidine-2,5-dione
PubChem CID63291448
Molecular FormulaC11H14N2O2S
Molecular Weight238.31 g/mol
Exact Mass238.08
IUPAC Name3-(1-thiophen-2-ylpropan-2-ylamino)pyrrolidine-2,5-dione
SMILESCC(Cc1cccs1)NC1CC(=O)NC1=O
InChIInChI=1S/C11H14N2O2S/c1-7(5-8-3-2-4-16-8)12-9-6-10(14)13-11(9)15/h2-4,7,9,12H,5-6H2,1H3,(H,13,14,15)
InChIKeyAKQDHJZELIFHBG-UHFFFAOYSA-N
XLogP0.68
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.31
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 3-(1-thiophen-2-ylpropan-2-ylamino)pyrrolidine-2,5-dione 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-propan-2-yl-3-(1-thiophen-2-ylpropan-2-ylamino)pyrrolidine-2,5-dione
CID 63291491
N-(1-thiophen-2-ylpropan-2-yl)cyclopropanamine
CID 82262604
5-fluoro-3-(1-thiophen-2-ylpropan-2-ylamino)-1,3-dihydroindol-2-one
CID 43692702
N-(1-thiophen-2-ylpropan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-4-amine
CID 62842653
4-(1-thiophen-2-ylpropan-2-ylamino)cyclohexan-1-ol
CID 103904586
4,4-dimethyl-N-(1-thiophen-2-ylpropan-2-yl)thian-3-amine
CID 79948426
N-propan-2-yl-1-thiophen-2-ylpropan-2-amine
CID 15162973
2,2-dimethyl-N-(1-thiophen-2-ylpropan-2-yl)-1,3-dihydroinden-1-amine
CID 82821062
1-phenyl-3-(1-thiophen-2-ylpropan-2-ylamino)cyclobutane-1-carbonitrile
CID 64904212
4-propyl-N-(1-thiophen-2-ylpropan-2-yl)cyclohexan-1-amine
CID 43432822
4-methyl-N-(1-thiophen-2-ylpropan-2-yl)cycloheptan-1-amine
CID 65081242
3-(4-methoxyphenyl)-N-(1-thiophen-2-ylpropan-2-yl)cyclobutan-1-amine
CID 43692803

Frequently Asked Questions

What is the IUPAC name of 3-(1-thiophen-2-ylpropan-2-ylamino)pyrrolidine-2,5-dione?
The IUPAC name of 3-(1-thiophen-2-ylpropan-2-ylamino)pyrrolidine-2,5-dione (CID 63291448) is 3-(1-thiophen-2-ylpropan-2-ylamino)pyrrolidine-2,5-dione.
What is the SMILES notation for 3-(1-thiophen-2-ylpropan-2-ylamino)pyrrolidine-2,5-dione?
The canonical SMILES for 3-(1-thiophen-2-ylpropan-2-ylamino)pyrrolidine-2,5-dione is CC(Cc1cccs1)NC1CC(=O)NC1=O.
What is the InChIKey of 3-(1-thiophen-2-ylpropan-2-ylamino)pyrrolidine-2,5-dione?
The InChIKey is AKQDHJZELIFHBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2S/c1-7(5-8-3-2-4-16-8)12-9-6-10(14)13-11(9)15/h2-4,7,9,12H,5-6H2,1H3,(H,13,14,15).
What are the key properties of 3-(1-thiophen-2-ylpropan-2-ylamino)pyrrolidine-2,5-dione?
3-(1-thiophen-2-ylpropan-2-ylamino)pyrrolidine-2,5-dione has a molecular weight of 238.31 g/mol, XLogP of 0.68, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-thiophen-2-ylpropan-2-ylamino)pyrrolidine-2,5-dione is sourced from PubChem (CID 63291448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).