5-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-methyl-2-(methylamino)pentanamide

C13H23N3O3 — CID 65301490

IUPAC5-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-methyl-2-(methylamino)pentanamide
SMILESCNC(C)(CCCN1C(=O)CC(C)(C)C1=O)C(N)=O
InChIInChI=1S/C13H23N3O3/c1-12(2)8-9(17)16(11(12)19)7-5-6-13(3,15-4)10(14)18/h15H,5-8H2,1-4H3,(H2,14,18)
InChIKeyGVHPOPQYQJPBNM-UHFFFAOYSA-N
MW269.34 g/mol
LogP0.02
Rot. Bonds6

About 5-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-methyl-2-(methylamino)pentanamide

5-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-methyl-2-(methylamino)pentanamide (PubChem CID 65301490) has the molecular formula C13H23N3O3 and a molecular weight of 269.34 g/mol. Its IUPAC name is 5-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-methyl-2-(methylamino)pentanamide.

Molecular Properties

Compound Name5-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-methyl-2-(methylamino)pentanamide
PubChem CID65301490
Molecular FormulaC13H23N3O3
Molecular Weight269.34 g/mol
Exact Mass269.17
IUPAC Name5-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-methyl-2-(methylamino)pentanamide
SMILESCNC(C)(CCCN1C(=O)CC(C)(C)C1=O)C(N)=O
InChIInChI=1S/C13H23N3O3/c1-12(2)8-9(17)16(11(12)19)7-5-6-13(3,15-4)10(14)18/h15H,5-8H2,1-4H3,(H2,14,18)
InChIKeyGVHPOPQYQJPBNM-UHFFFAOYSA-N
XLogP0.02
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 50.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-(ethylamino)-2-methylbutanamide
CID 65301884
1-(6-amino-5,5-dimethylhexyl)-3,3-dimethylpyrrolidine-2,5-dione
CID 106708431
6-(2,4-dioxo-3-azabicyclo[3.1.0]hexan-3-yl)-2-methyl-2-(methylamino)hexanamide
CID 64836259
5-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)pentanehydrazide
CID 65301201
1-(3-hydroxy-3-methylbutyl)-3,3-dimethylpyrrolidine-2,5-dione
CID 79360715
methyl 2-amino-4-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-methylbutanoate
CID 65301393
3,3-dimethyl-1-(4-oxopentyl)pyrrolidine-2,5-dione
CID 65301376
4-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-(methylamino)butanamide
CID 65301828
4-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-methyl-2-(methylamino)butanenitrile
CID 65301628
ethyl 4-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-(ethylamino)-2-methylbutanoate
CID 65301636
1-hex-5-ynyl-3,3-dimethylpyrrolidine-2,5-dione
CID 106209087
3,3-dimethyl-1-[2-(methylamino)ethyl]pyrrolidine-2,5-dione
CID 65297434

Frequently Asked Questions

What is the IUPAC name of 5-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-methyl-2-(methylamino)pentanamide?
The IUPAC name of 5-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-methyl-2-(methylamino)pentanamide (CID 65301490) is 5-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-methyl-2-(methylamino)pentanamide.
What is the SMILES notation for 5-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-methyl-2-(methylamino)pentanamide?
The canonical SMILES for 5-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-methyl-2-(methylamino)pentanamide is CNC(C)(CCCN1C(=O)CC(C)(C)C1=O)C(N)=O.
What is the InChIKey of 5-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-methyl-2-(methylamino)pentanamide?
The InChIKey is GVHPOPQYQJPBNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O3/c1-12(2)8-9(17)16(11(12)19)7-5-6-13(3,15-4)10(14)18/h15H,5-8H2,1-4H3,(H2,14,18).
What are the key properties of 5-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-methyl-2-(methylamino)pentanamide?
5-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-methyl-2-(methylamino)pentanamide has a molecular weight of 269.34 g/mol, XLogP of 0.02, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-methyl-2-(methylamino)pentanamide is sourced from PubChem (CID 65301490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).