1-(2,3-dihydro-1H-inden-5-yl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]-5-oxopyrrolidine-3-carboxamide

C22H20N4O3 — CID 43061649

About 1-(2,3-dihydro-1H-inden-5-yl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]-5-oxopyrrolidine-3-carboxamide

1-(2,3-dihydro-1H-inden-5-yl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]-5-oxopyrrolidine-3-carboxamide (PubChem CID 43061649) has the molecular formula C22H20N4O3 and a molecular weight of 388.43 g/mol. Its IUPAC name is 1-(2,3-dihydro-1H-inden-5-yl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

• Compound Name: 1-(2,3-dihydro-1H-inden-5-yl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]-5-oxopyrrolidine-3-carboxamide
• PubChem CID: 43061649
• Molecular Formula: C22H20N4O3
• Molecular Weight: 388.43 g/mol
• Exact Mass: 388.15
• IUPAC Name: 1-(2,3-dihydro-1H-inden-5-yl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]-5-oxopyrrolidine-3-carboxamide
• SMILES: O=C(Nc1cccc(-c2nnco2)c1)C1CC(=O)N(c2ccc3c(c2)CCC3)C1
• InChI: InChI=1S/C22H20N4O3/c27-20-11-17(12-26(20)19-8-7-14-3-1-4-15(14)10-19)21(28)24-18-6-2-5-16(9-18)22-25-23-13-29-22/h2,5-10,13,17H,1,3-4,11-12H2,(H,24,28)
• InChIKey: ICNHKMZLGSTFSN-UHFFFAOYSA-N
• XLogP: 3.22
• TPSA: 88.33 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 4
• Heavy Atoms: 29
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	388.43
LogP ≤ 5	3.22
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1H-inden-5-yl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]-5-oxopyrrolidine-3-carboxamide?

The IUPAC name of 1-(2,3-dihydro-1H-inden-5-yl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]-5-oxopyrrolidine-3-carboxamide (CID 43061649) is 1-(2,3-dihydro-1H-inden-5-yl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]-5-oxopyrrolidine-3-carboxamide.

What is the SMILES notation for 1-(2,3-dihydro-1H-inden-5-yl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]-5-oxopyrrolidine-3-carboxamide?

The canonical SMILES for 1-(2,3-dihydro-1H-inden-5-yl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]-5-oxopyrrolidine-3-carboxamide is O=C(Nc1cccc(-c2nnco2)c1)C1CC(=O)N(c2ccc3c(c2)CCC3)C1.

What is the InChIKey of 1-(2,3-dihydro-1H-inden-5-yl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]-5-oxopyrrolidine-3-carboxamide?

The InChIKey is ICNHKMZLGSTFSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N4O3/c27-20-11-17(12-26(20)19-8-7-14-3-1-4-15(14)10-19)21(28)24-18-6-2-5-16(9-18)22-25-23-13-29-22/h2,5-10,13,17H,1,3-4,11-12H2,(H,24,28).

What are the key properties of 1-(2,3-dihydro-1H-inden-5-yl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]-5-oxopyrrolidine-3-carboxamide?

1-(2,3-dihydro-1H-inden-5-yl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]-5-oxopyrrolidine-3-carboxamide has a molecular weight of 388.43 g/mol, XLogP of 3.22, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(2,3-dihydro-1H-inden-5-yl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 43061649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).