3-[(1-cyclopentyl-2,5-dioxopyrrolidin-3-yl)amino]-2,2-dimethylpropanamide

C14H23N3O3 — CID 106275843

IUPAC3-[(1-cyclopentyl-2,5-dioxopyrrolidin-3-yl)amino]-2,2-dimethylpropanamide
SMILESCC(C)(CNC1CC(=O)N(C2CCCC2)C1=O)C(N)=O
InChIInChI=1S/C14H23N3O3/c1-14(2,13(15)20)8-16-10-7-11(18)17(12(10)19)9-5-3-4-6-9/h9-10,16H,3-8H2,1-2H3,(H2,15,20)
InChIKeyXZPLJSTYJRGPHC-UHFFFAOYSA-N
MW281.36 g/mol
LogP0.16
Rot. Bonds5

About 3-[(1-cyclopentyl-2,5-dioxopyrrolidin-3-yl)amino]-2,2-dimethylpropanamide

3-[(1-cyclopentyl-2,5-dioxopyrrolidin-3-yl)amino]-2,2-dimethylpropanamide (PubChem CID 106275843) has the molecular formula C14H23N3O3 and a molecular weight of 281.36 g/mol. Its IUPAC name is 3-[(1-cyclopentyl-2,5-dioxopyrrolidin-3-yl)amino]-2,2-dimethylpropanamide.

Molecular Properties

Compound Name3-[(1-cyclopentyl-2,5-dioxopyrrolidin-3-yl)amino]-2,2-dimethylpropanamide
PubChem CID106275843
Molecular FormulaC14H23N3O3
Molecular Weight281.36 g/mol
Exact Mass281.17
IUPAC Name3-[(1-cyclopentyl-2,5-dioxopyrrolidin-3-yl)amino]-2,2-dimethylpropanamide
SMILESCC(C)(CNC1CC(=O)N(C2CCCC2)C1=O)C(N)=O
InChIInChI=1S/C14H23N3O3/c1-14(2,13(15)20)8-16-10-7-11(18)17(12(10)19)9-5-3-4-6-9/h9-10,16H,3-8H2,1-2H3,(H2,15,20)
InChIKeyXZPLJSTYJRGPHC-UHFFFAOYSA-N
XLogP0.16
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 50.16
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

1-cycloheptyl-3-(2,2-dimethylpropylamino)pyrrolidine-2,5-dione
CID 61166039
2-[(1-cycloheptyl-2,5-dioxopyrrolidin-3-yl)amino]acetamide
CID 43637319
1-cyclopentyl-3-[(2-ethoxy-2-methylpropyl)amino]pyrrolidine-2,5-dione
CID 114941620
1-cycloheptyl-3-(3-methylbut-2-enylamino)pyrrolidine-2,5-dione
CID 106188046
2-[(1-cyclopentyl-2,5-dioxopyrrolidin-3-yl)amino]-2-methylbutanoic acid
CID 79788639
2,2-dimethyl-3-[(1-methyl-2-oxopyrrolidin-3-yl)amino]propanamide
CID 106275991
1-cyclopropyl-3-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]pyrrolidine-2,5-dione
CID 43636402
1-cyclohexyl-3-(cyclopropylmethylamino)pyrrolidine-2,5-dione
CID 43637329
3-(butylamino)-1-cycloheptylpyrrolidine-2,5-dione
CID 43637456
1-cyclopentyl-3-(pentylamino)pyrrolidine-2,5-dione
CID 43637430
1-cyclopentyl-3-[2-(diethylamino)ethylamino]pyrrolidine-2,5-dione
CID 43637333
1-cyclopentyl-3-(octylamino)pyrrolidine-2,5-dione
CID 115567309

Frequently Asked Questions

What is the IUPAC name of 3-[(1-cyclopentyl-2,5-dioxopyrrolidin-3-yl)amino]-2,2-dimethylpropanamide?
The IUPAC name of 3-[(1-cyclopentyl-2,5-dioxopyrrolidin-3-yl)amino]-2,2-dimethylpropanamide (CID 106275843) is 3-[(1-cyclopentyl-2,5-dioxopyrrolidin-3-yl)amino]-2,2-dimethylpropanamide.
What is the SMILES notation for 3-[(1-cyclopentyl-2,5-dioxopyrrolidin-3-yl)amino]-2,2-dimethylpropanamide?
The canonical SMILES for 3-[(1-cyclopentyl-2,5-dioxopyrrolidin-3-yl)amino]-2,2-dimethylpropanamide is CC(C)(CNC1CC(=O)N(C2CCCC2)C1=O)C(N)=O.
What is the InChIKey of 3-[(1-cyclopentyl-2,5-dioxopyrrolidin-3-yl)amino]-2,2-dimethylpropanamide?
The InChIKey is XZPLJSTYJRGPHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O3/c1-14(2,13(15)20)8-16-10-7-11(18)17(12(10)19)9-5-3-4-6-9/h9-10,16H,3-8H2,1-2H3,(H2,15,20).
What are the key properties of 3-[(1-cyclopentyl-2,5-dioxopyrrolidin-3-yl)amino]-2,2-dimethylpropanamide?
3-[(1-cyclopentyl-2,5-dioxopyrrolidin-3-yl)amino]-2,2-dimethylpropanamide has a molecular weight of 281.36 g/mol, XLogP of 0.16, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1-cyclopentyl-2,5-dioxopyrrolidin-3-yl)amino]-2,2-dimethylpropanamide is sourced from PubChem (CID 106275843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).