1-[2-oxo-2-[4-(9-oxofluorene-2-carbonyl)piperazin-1-yl]ethyl]pyrrolidine-2,5-dione

C24H21N3O5 — CID 55950727

IUPAC1-[2-oxo-2-[4-(9-oxofluorene-2-carbonyl)piperazin-1-yl]ethyl]pyrrolidine-2,5-dione
SMILESO=C1c2ccccc2-c2ccc(C(=O)N3CCN(C(=O)CN4C(=O)CCC4=O)CC3)cc21
InChIInChI=1S/C24H21N3O5/c28-20-7-8-21(29)27(20)14-22(30)25-9-11-26(12-10-25)24(32)15-5-6-17-16-3-1-2-4-18(16)23(31)19(17)13-15/h1-6,13H,7-12,14H2
InChIKeyASDTUHHREGFRPY-UHFFFAOYSA-N
MW431.45 g/mol
LogP1.33
Rot. Bonds3

About 1-[2-oxo-2-[4-(9-oxofluorene-2-carbonyl)piperazin-1-yl]ethyl]pyrrolidine-2,5-dione

1-[2-oxo-2-[4-(9-oxofluorene-2-carbonyl)piperazin-1-yl]ethyl]pyrrolidine-2,5-dione (PubChem CID 55950727) has the molecular formula C24H21N3O5 and a molecular weight of 431.45 g/mol. Its IUPAC name is 1-[2-oxo-2-[4-(9-oxofluorene-2-carbonyl)piperazin-1-yl]ethyl]pyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-[2-oxo-2-[4-(9-oxofluorene-2-carbonyl)piperazin-1-yl]ethyl]pyrrolidine-2,5-dione
PubChem CID55950727
Molecular FormulaC24H21N3O5
Molecular Weight431.45 g/mol
Exact Mass431.15
IUPAC Name1-[2-oxo-2-[4-(9-oxofluorene-2-carbonyl)piperazin-1-yl]ethyl]pyrrolidine-2,5-dione
SMILESO=C1c2ccccc2-c2ccc(C(=O)N3CCN(C(=O)CN4C(=O)CCC4=O)CC3)cc21
InChIInChI=1S/C24H21N3O5/c28-20-7-8-21(29)27(20)14-22(30)25-9-11-26(12-10-25)24(32)15-5-6-17-16-3-1-2-4-18(16)23(31)19(17)13-15/h1-6,13H,7-12,14H2
InChIKeyASDTUHHREGFRPY-UHFFFAOYSA-N
XLogP1.33
TPSA95.07 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.45
LogP ≤ 51.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 1-[2-oxo-2-[4-(9-oxofluorene-2-carbonyl)piperazin-1-yl]ethyl]pyrrolidine-2,5-dione with MolForge

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Related Compounds

ethyl 4-(9-oxofluorene-2-carbonyl)piperazine-1-carboxylate
CID 17446072
2-[4-(furan-3-carbonyl)piperazine-1-carbonyl]fluoren-9-one
CID 32534624
2-(4-hydroxypiperidine-1-carbonyl)fluoren-9-one
CID 110883962
1-[2-oxo-2-[4-[3-(trifluoromethyl)benzoyl]piperazin-1-yl]ethyl]pyrrolidine-2,5-dione
CID 47043284
[4-(9,10-dioxoanthracene-2-carbonyl)piperazin-1-yl]methanesulfinate
CID 170189766
2-(1,1-dioxo-1,4-thiazinane-4-carbonyl)anthracene-9,10-dione
CID 169240438
2-[4-(2,3-dichlorobenzoyl)piperazine-1-carbonyl]fluoren-9-one
CID 55800240
1-[2-[4-[4-(difluoromethoxy)-3-methoxybenzoyl]piperazin-1-yl]-2-oxoethyl]pyrrolidine-2,5-dione
CID 55826399
2-[2-[4-(4-methylbenzoyl)piperazin-1-yl]-2-oxoethyl]isoindole-1,3-dione
CID 110365431
2-[2-[4-(3-hydroxybenzoyl)piperazin-1-yl]-2-oxoethyl]isoindole-1,3-dione
CID 108535196
2-(4-phenylpiperidine-1-carbonyl)anthracene-9,10-dione
CID 633858
2-[2-[4-(3,5-dihydroxybenzoyl)piperazin-1-yl]-2-oxoethyl]isoindole-1,3-dione
CID 108535195

Frequently Asked Questions

What is the IUPAC name of 1-[2-oxo-2-[4-(9-oxofluorene-2-carbonyl)piperazin-1-yl]ethyl]pyrrolidine-2,5-dione?
The IUPAC name of 1-[2-oxo-2-[4-(9-oxofluorene-2-carbonyl)piperazin-1-yl]ethyl]pyrrolidine-2,5-dione (CID 55950727) is 1-[2-oxo-2-[4-(9-oxofluorene-2-carbonyl)piperazin-1-yl]ethyl]pyrrolidine-2,5-dione.
What is the SMILES notation for 1-[2-oxo-2-[4-(9-oxofluorene-2-carbonyl)piperazin-1-yl]ethyl]pyrrolidine-2,5-dione?
The canonical SMILES for 1-[2-oxo-2-[4-(9-oxofluorene-2-carbonyl)piperazin-1-yl]ethyl]pyrrolidine-2,5-dione is O=C1c2ccccc2-c2ccc(C(=O)N3CCN(C(=O)CN4C(=O)CCC4=O)CC3)cc21.
What is the InChIKey of 1-[2-oxo-2-[4-(9-oxofluorene-2-carbonyl)piperazin-1-yl]ethyl]pyrrolidine-2,5-dione?
The InChIKey is ASDTUHHREGFRPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3O5/c28-20-7-8-21(29)27(20)14-22(30)25-9-11-26(12-10-25)24(32)15-5-6-17-16-3-1-2-4-18(16)23(31)19(17)13-15/h1-6,13H,7-12,14H2.
What are the key properties of 1-[2-oxo-2-[4-(9-oxofluorene-2-carbonyl)piperazin-1-yl]ethyl]pyrrolidine-2,5-dione?
1-[2-oxo-2-[4-(9-oxofluorene-2-carbonyl)piperazin-1-yl]ethyl]pyrrolidine-2,5-dione has a molecular weight of 431.45 g/mol, XLogP of 1.33, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-oxo-2-[4-(9-oxofluorene-2-carbonyl)piperazin-1-yl]ethyl]pyrrolidine-2,5-dione is sourced from PubChem (CID 55950727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).