1-methyl-3-phenylpyrrolidine-2,5-dione

C11H11NO2 — CID 6839

💊View drug profile → phensuximide
IUPAC1-methyl-3-phenylpyrrolidine-2,5-dione
SMILESCN1C(=O)CC(c2ccccc2)C1=O
InChIInChI=1S/C11H11NO2/c1-12-10(13)7-9(11(12)14)8-5-3-2-4-6-8/h2-6,9H,7H2,1H3
InChIKeyWLWFNJKHKGIJNW-UHFFFAOYSA-N
MW189.21 g/mol
LogP1.16
Rot. Bonds1

About 1-methyl-3-phenylpyrrolidine-2,5-dione

1-methyl-3-phenylpyrrolidine-2,5-dione (PubChem CID 6839) has the molecular formula C11H11NO2 and a molecular weight of 189.21 g/mol. Its IUPAC name is 1-methyl-3-phenylpyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-methyl-3-phenylpyrrolidine-2,5-dione
PubChem CID6839
Molecular FormulaC11H11NO2
Molecular Weight189.21 g/mol
Exact Mass189.08
IUPAC Name1-methyl-3-phenylpyrrolidine-2,5-dione
SMILESCN1C(=O)CC(c2ccccc2)C1=O
InChIInChI=1S/C11H11NO2/c1-12-10(13)7-9(11(12)14)8-5-3-2-4-6-8/h2-6,9H,7H2,1H3
InChIKeyWLWFNJKHKGIJNW-UHFFFAOYSA-N
XLogP1.16
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.21
LogP ≤ 51.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Methsuximide
CID 6476
Diphenamid
CID 13728
N,N-Diethyl-2-phenylacetamide
CID 17076
Fonturacetam
CID 132441
4-Phenyl-2-pyrrolidinone
CID 121397
1-(Phenylmethyl)-2,5-pyrrolidinedione
CID 95241
1,5-Dimethyl-3,3-diphenylpyrrolidin-2-one
CID 207584
Fenimide
CID 6068
Spiro-carboxamide scaffold, 13
CID 44143299
2,5-Pyrrolidinedione, 1-(2-phenylethyl)-
CID 95826
Glutarimide, N-ethyl-3-phenyl-
CID 3043002
Acetic acid, 2-(2-phenylsuccinimido)-, ethyl ester
CID 47404

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-phenylpyrrolidine-2,5-dione?
The IUPAC name of 1-methyl-3-phenylpyrrolidine-2,5-dione (CID 6839) is 1-methyl-3-phenylpyrrolidine-2,5-dione.
What is the SMILES notation for 1-methyl-3-phenylpyrrolidine-2,5-dione?
The canonical SMILES for 1-methyl-3-phenylpyrrolidine-2,5-dione is CN1C(=O)CC(c2ccccc2)C1=O.
What is the InChIKey of 1-methyl-3-phenylpyrrolidine-2,5-dione?
The InChIKey is WLWFNJKHKGIJNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO2/c1-12-10(13)7-9(11(12)14)8-5-3-2-4-6-8/h2-6,9H,7H2,1H3.
What are the key properties of 1-methyl-3-phenylpyrrolidine-2,5-dione?
1-methyl-3-phenylpyrrolidine-2,5-dione has a molecular weight of 189.21 g/mol, XLogP of 1.16, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-phenylpyrrolidine-2,5-dione is sourced from PubChem (CID 6839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).