2-(2,5-dioxopyrrolidin-1-yl)-N-[(1-thiophen-3-ylcyclopentyl)methyl]acetamide

C16H20N2O3S — CID 86263755

IUPAC2-(2,5-dioxopyrrolidin-1-yl)-N-[(1-thiophen-3-ylcyclopentyl)methyl]acetamide
SMILESO=C(CN1C(=O)CCC1=O)NCC1(c2ccsc2)CCCC1
InChIInChI=1S/C16H20N2O3S/c19-13(9-18-14(20)3-4-15(18)21)17-11-16(6-1-2-7-16)12-5-8-22-10-12/h5,8,10H,1-4,6-7,9,11H2,(H,17,19)
InChIKeyGHSRCUJNUMGNDY-UHFFFAOYSA-N
MW320.41 g/mol
LogP1.83
Rot. Bonds5

About 2-(2,5-dioxopyrrolidin-1-yl)-N-[(1-thiophen-3-ylcyclopentyl)methyl]acetamide

2-(2,5-dioxopyrrolidin-1-yl)-N-[(1-thiophen-3-ylcyclopentyl)methyl]acetamide (PubChem CID 86263755) has the molecular formula C16H20N2O3S and a molecular weight of 320.41 g/mol. Its IUPAC name is 2-(2,5-dioxopyrrolidin-1-yl)-N-[(1-thiophen-3-ylcyclopentyl)methyl]acetamide.

Molecular Properties

Compound Name2-(2,5-dioxopyrrolidin-1-yl)-N-[(1-thiophen-3-ylcyclopentyl)methyl]acetamide
PubChem CID86263755
Molecular FormulaC16H20N2O3S
Molecular Weight320.41 g/mol
Exact Mass320.12
IUPAC Name2-(2,5-dioxopyrrolidin-1-yl)-N-[(1-thiophen-3-ylcyclopentyl)methyl]acetamide
SMILESO=C(CN1C(=O)CCC1=O)NCC1(c2ccsc2)CCCC1
InChIInChI=1S/C16H20N2O3S/c19-13(9-18-14(20)3-4-15(18)21)17-11-16(6-1-2-7-16)12-5-8-22-10-12/h5,8,10H,1-4,6-7,9,11H2,(H,17,19)
InChIKeyGHSRCUJNUMGNDY-UHFFFAOYSA-N
XLogP1.83
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.41
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(2S)-2-(2-oxo-4-thiophen-3-ylpyrrolidin-1-yl)butanamide
CID 9964929
N'-[2-(cyclohex-1-en-1-yl)ethyl]-N-{[1-(thiophen-2-yl)cyclopentyl]methyl}ethanediamide
CID 25882759
2-(2,5-dioxopyrrolidin-1-yl)-N-{[1-(thiophen-2-yl)cyclopropyl]methyl}acetamide
CID 45561527
N1-(2-methoxyethyl)-N2-((1-(thiophen-3-yl)cyclopentyl)methyl)oxalamide
CID 86263792
2-(cyclopentylthio)-N-((1-(thiophen-3-yl)cyclopentyl)methyl)acetamide
CID 86264320
2-(2,5-dioxopyrrolidin-1-yl)-N-[2-(thiophen-3-yl)ethyl]acetamide
CID 49670248
N-[3-methyl-1-(2-methyl-4-thiophen-3-ylpyrrolidin-1-yl)-1-oxobutan-2-yl]acetamide
CID 72127594
2-(2,5-dioxopyrrolidin-1-yl)-N-(1-thiophen-3-ylpropan-2-yl)propanamide
CID 75416631
N1-((1-(thiophen-3-yl)cyclopentyl)methyl)-N2-(2,2,2-trifluoroethyl)oxalamide
CID 92066044
N-cyclopentyl-2-(3-methyl-2,5-dioxo-3-thiophen-3-ylpyrrolidin-1-yl)acetamide
CID 71851304
2-(2-methyl-4-thiophen-3-ylpyrrolidin-1-yl)-N-propylacetamide
CID 72127505
2-(2-Oxo-4-thiophen-3-ylpyrrolidin-1-yl)butanamide
CID 22387192

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dioxopyrrolidin-1-yl)-N-[(1-thiophen-3-ylcyclopentyl)methyl]acetamide?
The IUPAC name of 2-(2,5-dioxopyrrolidin-1-yl)-N-[(1-thiophen-3-ylcyclopentyl)methyl]acetamide (CID 86263755) is 2-(2,5-dioxopyrrolidin-1-yl)-N-[(1-thiophen-3-ylcyclopentyl)methyl]acetamide.
What is the SMILES notation for 2-(2,5-dioxopyrrolidin-1-yl)-N-[(1-thiophen-3-ylcyclopentyl)methyl]acetamide?
The canonical SMILES for 2-(2,5-dioxopyrrolidin-1-yl)-N-[(1-thiophen-3-ylcyclopentyl)methyl]acetamide is O=C(CN1C(=O)CCC1=O)NCC1(c2ccsc2)CCCC1.
What is the InChIKey of 2-(2,5-dioxopyrrolidin-1-yl)-N-[(1-thiophen-3-ylcyclopentyl)methyl]acetamide?
The InChIKey is GHSRCUJNUMGNDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O3S/c19-13(9-18-14(20)3-4-15(18)21)17-11-16(6-1-2-7-16)12-5-8-22-10-12/h5,8,10H,1-4,6-7,9,11H2,(H,17,19).
What are the key properties of 2-(2,5-dioxopyrrolidin-1-yl)-N-[(1-thiophen-3-ylcyclopentyl)methyl]acetamide?
2-(2,5-dioxopyrrolidin-1-yl)-N-[(1-thiophen-3-ylcyclopentyl)methyl]acetamide has a molecular weight of 320.41 g/mol, XLogP of 1.83, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dioxopyrrolidin-1-yl)-N-[(1-thiophen-3-ylcyclopentyl)methyl]acetamide is sourced from PubChem (CID 86263755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).