1-[3-(dimethylamino)propyl]-3-(2,2-dimethylpropyl)-4-methylpyrrolidine-2,5-dione

C15H28N2O2 — CID 20692366

IUPAC1-[3-(dimethylamino)propyl]-3-(2,2-dimethylpropyl)-4-methylpyrrolidine-2,5-dione
SMILESCC1C(=O)N(CCCN(C)C)C(=O)C1CC(C)(C)C
InChIInChI=1S/C15H28N2O2/c1-11-12(10-15(2,3)4)14(19)17(13(11)18)9-7-8-16(5)6/h11-12H,7-10H2,1-6H3
InChIKeyCEUFARBYQDLMTK-UHFFFAOYSA-N
MW268.40 g/mol
LogP2.00
Rot. Bonds5

About 1-[3-(dimethylamino)propyl]-3-(2,2-dimethylpropyl)-4-methylpyrrolidine-2,5-dione

1-[3-(dimethylamino)propyl]-3-(2,2-dimethylpropyl)-4-methylpyrrolidine-2,5-dione (PubChem CID 20692366) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 1-[3-(dimethylamino)propyl]-3-(2,2-dimethylpropyl)-4-methylpyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-[3-(dimethylamino)propyl]-3-(2,2-dimethylpropyl)-4-methylpyrrolidine-2,5-dione
PubChem CID20692366
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name1-[3-(dimethylamino)propyl]-3-(2,2-dimethylpropyl)-4-methylpyrrolidine-2,5-dione
SMILESCC1C(=O)N(CCCN(C)C)C(=O)C1CC(C)(C)C
InChIInChI=1S/C15H28N2O2/c1-11-12(10-15(2,3)4)14(19)17(13(11)18)9-7-8-16(5)6/h11-12H,7-10H2,1-6H3
InChIKeyCEUFARBYQDLMTK-UHFFFAOYSA-N
XLogP2.00
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 52.00
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

2-Azaspiro(4.4)nonane-1,3-dione, 2-propyl-
CID 56331
Valproyl-2-pyrrolidinone
CID 129151
3-isopropyl-N-methylsuccinimide
CID 57959296
3-[(3S)-3-methyl-3-(2-methylpropyl)-2,5-dioxopyrrolidin-1-yl]propanenitrile
CID 96391331
4-(4-Tert-butylazepane-1-carbonyl)-1-ethylpyrrolidin-2-one
CID 102557380
1-(5-Fluoro-4,5-dimethyl-6-oxoheptyl)-3-methylpyrrolidine-2,5-dione
CID 139406489
1,3-Diethyl-3-methyl-2,5-pyrrolidinedione
CID 587997
3-Tert-butyl-1-methylpyrrolidine-2,5-dione
CID 14736437
(1R,5S)-3,6,6,7,7-pentamethyl-3-azabicyclo[3.2.0]heptane-2,4-dione
CID 164670624
1-[(3S)-3-ethyl-4-methylpentanoyl]pyrrolidin-2-one
CID 178336495
1-(3-Amino-2,2-difluoropropyl)-3-methyl-3-propan-2-ylpyrrolidine-2,5-dione
CID 113577858
3-(2,2-Dimethylpropyl)-3-methyl-1-(2,2,2-trifluoroethyl)pyrrolidine-2,5-dione
CID 157234863

Frequently Asked Questions

What is the IUPAC name of 1-[3-(dimethylamino)propyl]-3-(2,2-dimethylpropyl)-4-methylpyrrolidine-2,5-dione?
The IUPAC name of 1-[3-(dimethylamino)propyl]-3-(2,2-dimethylpropyl)-4-methylpyrrolidine-2,5-dione (CID 20692366) is 1-[3-(dimethylamino)propyl]-3-(2,2-dimethylpropyl)-4-methylpyrrolidine-2,5-dione.
What is the SMILES notation for 1-[3-(dimethylamino)propyl]-3-(2,2-dimethylpropyl)-4-methylpyrrolidine-2,5-dione?
The canonical SMILES for 1-[3-(dimethylamino)propyl]-3-(2,2-dimethylpropyl)-4-methylpyrrolidine-2,5-dione is CC1C(=O)N(CCCN(C)C)C(=O)C1CC(C)(C)C.
What is the InChIKey of 1-[3-(dimethylamino)propyl]-3-(2,2-dimethylpropyl)-4-methylpyrrolidine-2,5-dione?
The InChIKey is CEUFARBYQDLMTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-11-12(10-15(2,3)4)14(19)17(13(11)18)9-7-8-16(5)6/h11-12H,7-10H2,1-6H3.
What are the key properties of 1-[3-(dimethylamino)propyl]-3-(2,2-dimethylpropyl)-4-methylpyrrolidine-2,5-dione?
1-[3-(dimethylamino)propyl]-3-(2,2-dimethylpropyl)-4-methylpyrrolidine-2,5-dione has a molecular weight of 268.40 g/mol, XLogP of 2.00, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(dimethylamino)propyl]-3-(2,2-dimethylpropyl)-4-methylpyrrolidine-2,5-dione is sourced from PubChem (CID 20692366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).