4-(2,5-dioxopyrrolidin-1-yl)-N-[(2R)-4-(furan-2-yl)butan-2-yl]benzamide

C19H20N2O4 — CID 39948589

IUPAC4-(2,5-dioxopyrrolidin-1-yl)-N-[(2R)-4-(furan-2-yl)butan-2-yl]benzamide
SMILESC[C@H](CCc1ccco1)NC(=O)c1ccc(N2C(=O)CCC2=O)cc1
InChIInChI=1S/C19H20N2O4/c1-13(4-9-16-3-2-12-25-16)20-19(24)14-5-7-15(8-6-14)21-17(22)10-11-18(21)23/h2-3,5-8,12-13H,4,9-11H2,1H3,(H,20,24)/t13-/m1/s1
InChIKeyZIZJHGNRRXDJEZ-CYBMUJFWSA-N
MW340.38 g/mol
LogP2.68
Rot. Bonds6

About 4-(2,5-dioxopyrrolidin-1-yl)-N-[(2R)-4-(furan-2-yl)butan-2-yl]benzamide

4-(2,5-dioxopyrrolidin-1-yl)-N-[(2R)-4-(furan-2-yl)butan-2-yl]benzamide (PubChem CID 39948589) has the molecular formula C19H20N2O4 and a molecular weight of 340.38 g/mol. Its IUPAC name is 4-(2,5-dioxopyrrolidin-1-yl)-N-[(2R)-4-(furan-2-yl)butan-2-yl]benzamide.

Molecular Properties

Compound Name4-(2,5-dioxopyrrolidin-1-yl)-N-[(2R)-4-(furan-2-yl)butan-2-yl]benzamide
PubChem CID39948589
Molecular FormulaC19H20N2O4
Molecular Weight340.38 g/mol
Exact Mass340.14
IUPAC Name4-(2,5-dioxopyrrolidin-1-yl)-N-[(2R)-4-(furan-2-yl)butan-2-yl]benzamide
SMILESC[C@H](CCc1ccco1)NC(=O)c1ccc(N2C(=O)CCC2=O)cc1
InChIInChI=1S/C19H20N2O4/c1-13(4-9-16-3-2-12-25-16)20-19(24)14-5-7-15(8-6-14)21-17(22)10-11-18(21)23/h2-3,5-8,12-13H,4,9-11H2,1H3,(H,20,24)/t13-/m1/s1
InChIKeyZIZJHGNRRXDJEZ-CYBMUJFWSA-N
XLogP2.68
TPSA79.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 52.68
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

4-(bromomethyl)-N-[4-(furan-2-yl)butan-2-yl]benzamide
CID 102851452
4-cyano-N-[(2S)-4-(furan-2-yl)butan-2-yl]benzamide
CID 9141737
N-[4-(furan-2-yl)butan-2-yl]-3,4-dihydroxybenzamide
CID 103956281
4-(benzimidazol-1-yl)-N-[(2S)-4-(furan-2-yl)butan-2-yl]benzamide
CID 25329425
4-(4-bromo-3,5-dimethylpyrazol-1-yl)-N-[4-(furan-2-yl)butan-2-yl]benzamide
CID 55606806
N-[4-(furan-2-yl)butan-2-yl]-4-(methylsulfamoyl)benzamide
CID 18162608
N-[4-(furan-2-yl)butan-2-yl]-3,5-dihydroxybenzamide
CID 104938782
4-[(carbamoylamino)methyl]-N-[4-(furan-2-yl)butan-2-yl]benzamide
CID 47010072
3,5-difluoro-N-[4-(furan-2-yl)butan-2-yl]benzamide
CID 18162420
N-[4-(furan-2-yl)butan-2-yl]-2-oxo-1H-pyridine-4-carboxamide
CID 103763430
N-[4-(furan-2-yl)butan-2-yl]thiophene-3-carboxamide
CID 18194695
3-amino-N-[4-(furan-2-yl)butan-2-yl]benzamide
CID 61249559

Frequently Asked Questions

What is the IUPAC name of 4-(2,5-dioxopyrrolidin-1-yl)-N-[(2R)-4-(furan-2-yl)butan-2-yl]benzamide?
The IUPAC name of 4-(2,5-dioxopyrrolidin-1-yl)-N-[(2R)-4-(furan-2-yl)butan-2-yl]benzamide (CID 39948589) is 4-(2,5-dioxopyrrolidin-1-yl)-N-[(2R)-4-(furan-2-yl)butan-2-yl]benzamide.
What is the SMILES notation for 4-(2,5-dioxopyrrolidin-1-yl)-N-[(2R)-4-(furan-2-yl)butan-2-yl]benzamide?
The canonical SMILES for 4-(2,5-dioxopyrrolidin-1-yl)-N-[(2R)-4-(furan-2-yl)butan-2-yl]benzamide is C[C@H](CCc1ccco1)NC(=O)c1ccc(N2C(=O)CCC2=O)cc1.
What is the InChIKey of 4-(2,5-dioxopyrrolidin-1-yl)-N-[(2R)-4-(furan-2-yl)butan-2-yl]benzamide?
The InChIKey is ZIZJHGNRRXDJEZ-CYBMUJFWSA-N. The full InChI is InChI=1S/C19H20N2O4/c1-13(4-9-16-3-2-12-25-16)20-19(24)14-5-7-15(8-6-14)21-17(22)10-11-18(21)23/h2-3,5-8,12-13H,4,9-11H2,1H3,(H,20,24)/t13-/m1/s1.
What are the key properties of 4-(2,5-dioxopyrrolidin-1-yl)-N-[(2R)-4-(furan-2-yl)butan-2-yl]benzamide?
4-(2,5-dioxopyrrolidin-1-yl)-N-[(2R)-4-(furan-2-yl)butan-2-yl]benzamide has a molecular weight of 340.38 g/mol, XLogP of 2.68, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5-dioxopyrrolidin-1-yl)-N-[(2R)-4-(furan-2-yl)butan-2-yl]benzamide is sourced from PubChem (CID 39948589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).