1'-[3-(diethylamino)propyl]spiro[1,3-dihydroindene-2,3'-pyrrolidine]-2',5'-dione

C19H26N2O2 — CID 3058832

IUPAC1'-[3-(diethylamino)propyl]spiro[1,3-dihydroindene-2,3'-pyrrolidine]-2',5'-dione
SMILESCCN(CC)CCCN1C(=O)CC2(Cc3ccccc3C2)C1=O
InChIInChI=1S/C19H26N2O2/c1-3-20(4-2)10-7-11-21-17(22)14-19(18(21)23)12-15-8-5-6-9-16(15)13-19/h5-6,8-9H,3-4,7,10-14H2,1-2H3
InChIKeyIJDLHHUXNBSHLD-UHFFFAOYSA-N
MW314.43 g/mol
LogP2.26
Rot. Bonds6

About 1'-[3-(diethylamino)propyl]spiro[1,3-dihydroindene-2,3'-pyrrolidine]-2',5'-dione

1'-[3-(diethylamino)propyl]spiro[1,3-dihydroindene-2,3'-pyrrolidine]-2',5'-dione (PubChem CID 3058832) has the molecular formula C19H26N2O2 and a molecular weight of 314.43 g/mol. Its IUPAC name is 1'-[3-(diethylamino)propyl]spiro[1,3-dihydroindene-2,3'-pyrrolidine]-2',5'-dione.

Molecular Properties

Compound Name1'-[3-(diethylamino)propyl]spiro[1,3-dihydroindene-2,3'-pyrrolidine]-2',5'-dione
PubChem CID3058832
Molecular FormulaC19H26N2O2
Molecular Weight314.43 g/mol
Exact Mass314.20
IUPAC Name1'-[3-(diethylamino)propyl]spiro[1,3-dihydroindene-2,3'-pyrrolidine]-2',5'-dione
SMILESCCN(CC)CCCN1C(=O)CC2(Cc3ccccc3C2)C1=O
InChIInChI=1S/C19H26N2O2/c1-3-20(4-2)10-7-11-21-17(22)14-19(18(21)23)12-15-8-5-6-9-16(15)13-19/h5-6,8-9H,3-4,7,10-14H2,1-2H3
InChIKeyIJDLHHUXNBSHLD-UHFFFAOYSA-N
XLogP2.26
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.43
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1'-[3-(diethylamino)propyl]spiro[1,3-dihydroindene-2,3'-pyrrolidine]-2',5'-dione?
The IUPAC name of 1'-[3-(diethylamino)propyl]spiro[1,3-dihydroindene-2,3'-pyrrolidine]-2',5'-dione (CID 3058832) is 1'-[3-(diethylamino)propyl]spiro[1,3-dihydroindene-2,3'-pyrrolidine]-2',5'-dione.
What is the SMILES notation for 1'-[3-(diethylamino)propyl]spiro[1,3-dihydroindene-2,3'-pyrrolidine]-2',5'-dione?
The canonical SMILES for 1'-[3-(diethylamino)propyl]spiro[1,3-dihydroindene-2,3'-pyrrolidine]-2',5'-dione is CCN(CC)CCCN1C(=O)CC2(Cc3ccccc3C2)C1=O.
What is the InChIKey of 1'-[3-(diethylamino)propyl]spiro[1,3-dihydroindene-2,3'-pyrrolidine]-2',5'-dione?
The InChIKey is IJDLHHUXNBSHLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O2/c1-3-20(4-2)10-7-11-21-17(22)14-19(18(21)23)12-15-8-5-6-9-16(15)13-19/h5-6,8-9H,3-4,7,10-14H2,1-2H3.
What are the key properties of 1'-[3-(diethylamino)propyl]spiro[1,3-dihydroindene-2,3'-pyrrolidine]-2',5'-dione?
1'-[3-(diethylamino)propyl]spiro[1,3-dihydroindene-2,3'-pyrrolidine]-2',5'-dione has a molecular weight of 314.43 g/mol, XLogP of 2.26, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-[3-(diethylamino)propyl]spiro[1,3-dihydroindene-2,3'-pyrrolidine]-2',5'-dione is sourced from PubChem (CID 3058832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).