1-(6-methyl-2-pyridinyl)-3-phenylpyrrolidine-2,5-dione

C16H14N2O2 — CID 3076814

IUPAC1-(6-methyl-2-pyridinyl)-3-phenylpyrrolidine-2,5-dione
SMILESCc1cccc(N2C(=O)CC(c3ccccc3)C2=O)n1
InChIInChI=1S/C16H14N2O2/c1-11-6-5-9-14(17-11)18-15(19)10-13(16(18)20)12-7-3-2-4-8-12/h2-9,13H,10H2,1H3
InChIKeyYOPZDCNJTUKYBD-UHFFFAOYSA-N
MW266.30 g/mol
LogP2.44
Rot. Bonds2

About 1-(6-methyl-2-pyridinyl)-3-phenylpyrrolidine-2,5-dione

1-(6-methyl-2-pyridinyl)-3-phenylpyrrolidine-2,5-dione (PubChem CID 3076814) has the molecular formula C16H14N2O2 and a molecular weight of 266.30 g/mol. Its IUPAC name is 1-(6-methyl-2-pyridinyl)-3-phenylpyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-(6-methyl-2-pyridinyl)-3-phenylpyrrolidine-2,5-dione
PubChem CID3076814
Molecular FormulaC16H14N2O2
Molecular Weight266.30 g/mol
Exact Mass266.11
IUPAC Name1-(6-methyl-2-pyridinyl)-3-phenylpyrrolidine-2,5-dione
SMILESCc1cccc(N2C(=O)CC(c3ccccc3)C2=O)n1
InChIInChI=1S/C16H14N2O2/c1-11-6-5-9-14(17-11)18-15(19)10-13(16(18)20)12-7-3-2-4-8-12/h2-9,13H,10H2,1H3
InChIKeyYOPZDCNJTUKYBD-UHFFFAOYSA-N
XLogP2.44
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-Methyl-N-(6-methyl-2-pyridinyl)benzamide
CID 966005
N-(4,6-dimethylpyridin-2-yl)-2-phenylbutanamide
CID 2852109
N-[[(6-methyl-2-pyridinyl)amino]-oxomethyl]benzamide
CID 5093257
2-(6-methylpyridin-2-yl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
CID 3406079
1-(4-Chloro-2-pyridinyl)-3-(1-phenylethyl)-2,5-pyrrolidinedione
CID 3753925
1-[(4-methylphenyl)methyl]-N-(6-methyl-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide
CID 16573437
1-benzyl-N-(6-methylpyridin-2-yl)-5-oxopyrrolidine-3-carboxamide
CID 24687433
1-(4,6-Dimethylpyrimidin-2-yl)-3-(4-methylbenzyl)pyrrolidine-2,5-dione
CID 3157157
6-Methyl-2-(phthalimido)pyridine
CID 692293
5-Methyl-2-quinolin-2-yl-3a,4,7,7a-tetrahydro-isoindole-1,3-dione
CID 645406
3-(1,3-Dioxo-1,3-dihydro-isoindol-2-yl)-N-(6-methyl-pyridin-2-yl)-propionamide
CID 654298
1-(6-Methyl-2-pyridinyl)-2,5-pyrrolidinedione
CID 692333

Frequently Asked Questions

What is the IUPAC name of 1-(6-methyl-2-pyridinyl)-3-phenylpyrrolidine-2,5-dione?
The IUPAC name of 1-(6-methyl-2-pyridinyl)-3-phenylpyrrolidine-2,5-dione (CID 3076814) is 1-(6-methyl-2-pyridinyl)-3-phenylpyrrolidine-2,5-dione.
What is the SMILES notation for 1-(6-methyl-2-pyridinyl)-3-phenylpyrrolidine-2,5-dione?
The canonical SMILES for 1-(6-methyl-2-pyridinyl)-3-phenylpyrrolidine-2,5-dione is Cc1cccc(N2C(=O)CC(c3ccccc3)C2=O)n1.
What is the InChIKey of 1-(6-methyl-2-pyridinyl)-3-phenylpyrrolidine-2,5-dione?
The InChIKey is YOPZDCNJTUKYBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2/c1-11-6-5-9-14(17-11)18-15(19)10-13(16(18)20)12-7-3-2-4-8-12/h2-9,13H,10H2,1H3.
What are the key properties of 1-(6-methyl-2-pyridinyl)-3-phenylpyrrolidine-2,5-dione?
1-(6-methyl-2-pyridinyl)-3-phenylpyrrolidine-2,5-dione has a molecular weight of 266.30 g/mol, XLogP of 2.44, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methyl-2-pyridinyl)-3-phenylpyrrolidine-2,5-dione is sourced from PubChem (CID 3076814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).