1-(4,6-diphenylpyrimidin-2-yl)-3,3,4,4-tetramethylpyrrolidine-2,5-dione

C24H23N3O2 — CID 177145002

IUPAC1-(4,6-diphenylpyrimidin-2-yl)-3,3,4,4-tetramethylpyrrolidine-2,5-dione
SMILESCC1(C)C(=O)N(c2nc(-c3ccccc3)cc(-c3ccccc3)n2)C(=O)C1(C)C
InChIInChI=1S/C24H23N3O2/c1-23(2)20(28)27(21(29)24(23,3)4)22-25-18(16-11-7-5-8-12-16)15-19(26-22)17-13-9-6-10-14-17/h5-15H,1-4H3
InChIKeyKRPYUAVQNFZQOG-UHFFFAOYSA-N
MW385.47 g/mol
LogP4.74
Rot. Bonds3

About 1-(4,6-diphenylpyrimidin-2-yl)-3,3,4,4-tetramethylpyrrolidine-2,5-dione

1-(4,6-diphenylpyrimidin-2-yl)-3,3,4,4-tetramethylpyrrolidine-2,5-dione (PubChem CID 177145002) has the molecular formula C24H23N3O2 and a molecular weight of 385.47 g/mol. Its IUPAC name is 1-(4,6-diphenylpyrimidin-2-yl)-3,3,4,4-tetramethylpyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-(4,6-diphenylpyrimidin-2-yl)-3,3,4,4-tetramethylpyrrolidine-2,5-dione
PubChem CID177145002
Molecular FormulaC24H23N3O2
Molecular Weight385.47 g/mol
Exact Mass385.18
IUPAC Name1-(4,6-diphenylpyrimidin-2-yl)-3,3,4,4-tetramethylpyrrolidine-2,5-dione
SMILESCC1(C)C(=O)N(c2nc(-c3ccccc3)cc(-c3ccccc3)n2)C(=O)C1(C)C
InChIInChI=1S/C24H23N3O2/c1-23(2)20(28)27(21(29)24(23,3)4)22-25-18(16-11-7-5-8-12-16)15-19(26-22)17-13-9-6-10-14-17/h5-15H,1-4H3
InChIKeyKRPYUAVQNFZQOG-UHFFFAOYSA-N
XLogP4.74
TPSA63.16 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.47
LogP ≤ 54.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 1-(4,6-diphenylpyrimidin-2-yl)-3,3,4,4-tetramethylpyrrolidine-2,5-dione 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

3,3,4,4-tetramethyl-1-[4-(3-phenylphenyl)-6-(4-phenylphenyl)pyrimidin-2-yl]pyrrolidine-2,5-dione
CID 177144976
3,3,4,4-tetramethyl-1-[4-phenyl-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazin-2-yl]pyrrolidine-2,5-dione
CID 177145055
10-[2-(9,9-dimethylacridin-10-yl)-6-phenylpyrimidin-4-yl]-9,9-dimethylacridine
CID 59399668
1-[4-carbazol-9-yl-6-[3-(9-phenylcarbazol-3-yl)phenyl]-1,3,5-triazin-2-yl]-3,3,4,4-tetramethylpyrrolidine-2,5-dione
CID 177144966
3,3,4,4-tetramethyl-1-[4-(9-phenylcarbazol-3-yl)quinazolin-2-yl]pyrrolidine-2,5-dione
CID 177144951
2,5-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-3a,6a-diphenylpyrrolo[3,4-c]pyrrole-1,3,4,6-tetrone
CID 177144892
14-(4,6-diphenylpyrimidin-2-yl)-21,21-dimethyl-10,10-diphenyl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene
CID 67472191
3,3,4,4-tetramethyl-1-[16-[3-(4-phenylphenyl)phenyl]-11-thia-13,15-diazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2,4,6,8,12,14,16-octaen-14-yl]pyrrolidine-2,5-dione
CID 177145058
5'-(4,6-diphenylpyrimidin-2-yl)-5-phenyl-10,10'-spirobi[benzo[b][1,4]benzazagermine]
CID 153437567
CID 163745467
CID 163745467
10-[5-(9,9-dimethylacridin-10-yl)-3,7-bis(2,6-diphenylpyrimidin-4-yl)naphthalen-1-yl]-9,9-dimethylacridine
CID 129290633
ethane;8,8,14,14,22,22-hexamethyl-5,11,17-triphenyl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene
CID 143425652

Frequently Asked Questions

What is the IUPAC name of 1-(4,6-diphenylpyrimidin-2-yl)-3,3,4,4-tetramethylpyrrolidine-2,5-dione?
The IUPAC name of 1-(4,6-diphenylpyrimidin-2-yl)-3,3,4,4-tetramethylpyrrolidine-2,5-dione (CID 177145002) is 1-(4,6-diphenylpyrimidin-2-yl)-3,3,4,4-tetramethylpyrrolidine-2,5-dione.
What is the SMILES notation for 1-(4,6-diphenylpyrimidin-2-yl)-3,3,4,4-tetramethylpyrrolidine-2,5-dione?
The canonical SMILES for 1-(4,6-diphenylpyrimidin-2-yl)-3,3,4,4-tetramethylpyrrolidine-2,5-dione is CC1(C)C(=O)N(c2nc(-c3ccccc3)cc(-c3ccccc3)n2)C(=O)C1(C)C.
What is the InChIKey of 1-(4,6-diphenylpyrimidin-2-yl)-3,3,4,4-tetramethylpyrrolidine-2,5-dione?
The InChIKey is KRPYUAVQNFZQOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O2/c1-23(2)20(28)27(21(29)24(23,3)4)22-25-18(16-11-7-5-8-12-16)15-19(26-22)17-13-9-6-10-14-17/h5-15H,1-4H3.
What are the key properties of 1-(4,6-diphenylpyrimidin-2-yl)-3,3,4,4-tetramethylpyrrolidine-2,5-dione?
1-(4,6-diphenylpyrimidin-2-yl)-3,3,4,4-tetramethylpyrrolidine-2,5-dione has a molecular weight of 385.47 g/mol, XLogP of 4.74, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,6-diphenylpyrimidin-2-yl)-3,3,4,4-tetramethylpyrrolidine-2,5-dione is sourced from PubChem (CID 177145002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).