(2R)-N-[(3R)-2,5-dioxo-1-propan-2-ylpyrrolidin-3-yl]-2-thiophen-3-ylpropanamide

C14H18N2O3S — CID 98343599

IUPAC(2R)-N-[(3R)-2,5-dioxo-1-propan-2-ylpyrrolidin-3-yl]-2-thiophen-3-ylpropanamide
SMILESCC(C)N1C(=O)C[C@@H](NC(=O)[C@H](C)c2ccsc2)C1=O
InChIInChI=1S/C14H18N2O3S/c1-8(2)16-12(17)6-11(14(16)19)15-13(18)9(3)10-4-5-20-7-10/h4-5,7-9,11H,6H2,1-3H3,(H,15,18)/t9-,11-/m1/s1
InChIKeyHMYHPWNAGURLGD-MWLCHTKSSA-N
MW294.38 g/mol
LogP1.50
Rot. Bonds4

About (2R)-N-[(3R)-2,5-dioxo-1-propan-2-ylpyrrolidin-3-yl]-2-thiophen-3-ylpropanamide

(2R)-N-[(3R)-2,5-dioxo-1-propan-2-ylpyrrolidin-3-yl]-2-thiophen-3-ylpropanamide (PubChem CID 98343599) has the molecular formula C14H18N2O3S and a molecular weight of 294.38 g/mol. Its IUPAC name is (2R)-N-[(3R)-2,5-dioxo-1-propan-2-ylpyrrolidin-3-yl]-2-thiophen-3-ylpropanamide.

Molecular Properties

Compound Name(2R)-N-[(3R)-2,5-dioxo-1-propan-2-ylpyrrolidin-3-yl]-2-thiophen-3-ylpropanamide
PubChem CID98343599
Molecular FormulaC14H18N2O3S
Molecular Weight294.38 g/mol
Exact Mass294.10
IUPAC Name(2R)-N-[(3R)-2,5-dioxo-1-propan-2-ylpyrrolidin-3-yl]-2-thiophen-3-ylpropanamide
SMILESCC(C)N1C(=O)C[C@@H](NC(=O)[C@H](C)c2ccsc2)C1=O
InChIInChI=1S/C14H18N2O3S/c1-8(2)16-12(17)6-11(14(16)19)15-13(18)9(3)10-4-5-20-7-10/h4-5,7-9,11H,6H2,1-3H3,(H,15,18)/t9-,11-/m1/s1
InChIKeyHMYHPWNAGURLGD-MWLCHTKSSA-N
XLogP1.50
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.38
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (2R)-N-[(3R)-2,5-dioxo-1-propan-2-ylpyrrolidin-3-yl]-2-thiophen-3-ylpropanamide 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

2-amino-N-(2,5-dioxo-1-propan-2-ylpyrrolidin-3-yl)-2-(4-methylphenyl)acetamide
CID 120669178
4-(dimethylamino)-N-(2,5-dioxo-1-propan-2-ylpyrrolidin-3-yl)benzamide
CID 122145655
2-amino-N-(2,5-dioxo-1-propan-2-ylpyrrolidin-3-yl)-2-(oxan-4-yl)acetamide
CID 120796324
N-[(3R)-2,5-dioxo-1-propan-2-ylpyrrolidin-3-yl]-2-methyl-1H-pyrrole-3-carboxamide
CID 98218270
N-[2-[2-[(2,5-dioxo-1-propan-2-ylpyrrolidin-3-yl)amino]-2-oxoethyl]phenyl]prop-2-enamide
CID 166420107
2,4-di(thiophen-3-yl)pentan-3-one
CID 67673002
1-cyclohexyl-3-(2,5-dioxo-1-propan-2-ylpyrrolidin-3-yl)urea
CID 71852782
2-amino-N-(2,5-dioxo-1-propan-2-ylpyrrolidin-3-yl)-2-(oxan-4-yl)acetamide;hydrochloride
CID 120796323
1-propan-2-yl-3-(pyrrol-1-ylamino)pyrrolidine-2,5-dione
CID 79100069
(2S)-2-[(2,5-dioxo-1-propan-2-ylpyrrolidin-3-yl)amino]propanoic acid
CID 83194716
(2R)-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-thiophen-3-ylpropanamide
CID 95773682
(2R)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-thiophen-3-ylpropanamide
CID 95773681

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(3R)-2,5-dioxo-1-propan-2-ylpyrrolidin-3-yl]-2-thiophen-3-ylpropanamide?
The IUPAC name of (2R)-N-[(3R)-2,5-dioxo-1-propan-2-ylpyrrolidin-3-yl]-2-thiophen-3-ylpropanamide (CID 98343599) is (2R)-N-[(3R)-2,5-dioxo-1-propan-2-ylpyrrolidin-3-yl]-2-thiophen-3-ylpropanamide.
What is the SMILES notation for (2R)-N-[(3R)-2,5-dioxo-1-propan-2-ylpyrrolidin-3-yl]-2-thiophen-3-ylpropanamide?
The canonical SMILES for (2R)-N-[(3R)-2,5-dioxo-1-propan-2-ylpyrrolidin-3-yl]-2-thiophen-3-ylpropanamide is CC(C)N1C(=O)C[C@@H](NC(=O)[C@H](C)c2ccsc2)C1=O.
What is the InChIKey of (2R)-N-[(3R)-2,5-dioxo-1-propan-2-ylpyrrolidin-3-yl]-2-thiophen-3-ylpropanamide?
The InChIKey is HMYHPWNAGURLGD-MWLCHTKSSA-N. The full InChI is InChI=1S/C14H18N2O3S/c1-8(2)16-12(17)6-11(14(16)19)15-13(18)9(3)10-4-5-20-7-10/h4-5,7-9,11H,6H2,1-3H3,(H,15,18)/t9-,11-/m1/s1.
What are the key properties of (2R)-N-[(3R)-2,5-dioxo-1-propan-2-ylpyrrolidin-3-yl]-2-thiophen-3-ylpropanamide?
(2R)-N-[(3R)-2,5-dioxo-1-propan-2-ylpyrrolidin-3-yl]-2-thiophen-3-ylpropanamide has a molecular weight of 294.38 g/mol, XLogP of 1.50, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(3R)-2,5-dioxo-1-propan-2-ylpyrrolidin-3-yl]-2-thiophen-3-ylpropanamide is sourced from PubChem (CID 98343599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).