3-methyl-1-(2-propan-2-yloxyethyl)pyrrolidine-2,5-dione

C10H17NO3 — CID 167490860

IUPAC3-methyl-1-(2-propan-2-yloxyethyl)pyrrolidine-2,5-dione
SMILESCC(C)OCCN1C(=O)CC(C)C1=O
InChIInChI=1S/C10H17NO3/c1-7(2)14-5-4-11-9(12)6-8(3)10(11)13/h7-8H,4-6H2,1-3H3
InChIKeyWSVXONBHWKFFFX-UHFFFAOYSA-N
MW199.25 g/mol
LogP0.81
Rot. Bonds4

About 3-methyl-1-(2-propan-2-yloxyethyl)pyrrolidine-2,5-dione

3-methyl-1-(2-propan-2-yloxyethyl)pyrrolidine-2,5-dione (PubChem CID 167490860) has the molecular formula C10H17NO3 and a molecular weight of 199.25 g/mol. Its IUPAC name is 3-methyl-1-(2-propan-2-yloxyethyl)pyrrolidine-2,5-dione.

Molecular Properties

Compound Name3-methyl-1-(2-propan-2-yloxyethyl)pyrrolidine-2,5-dione
PubChem CID167490860
Molecular FormulaC10H17NO3
Molecular Weight199.25 g/mol
Exact Mass199.12
IUPAC Name3-methyl-1-(2-propan-2-yloxyethyl)pyrrolidine-2,5-dione
SMILESCC(C)OCCN1C(=O)CC(C)C1=O
InChIInChI=1S/C10H17NO3/c1-7(2)14-5-4-11-9(12)6-8(3)10(11)13/h7-8H,4-6H2,1-3H3
InChIKeyWSVXONBHWKFFFX-UHFFFAOYSA-N
XLogP0.81
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 50.81
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-1-[2-[2-[2-(3-methyl-2,5-dioxopyrrolidin-1-yl)ethoxy]propan-2-yloxy]ethyl]pyrrolidine-2,5-dione
CID 163797402
1-[2-(2-aminoethoxy)ethyl]-3-methylpyrrolidine-2,5-dione
CID 103482320
1-[2-[2-[2-[2-(2,5-dioxo-3-sulfanylpyrrolidin-1-yl)ethoxy]ethoxy]ethoxy]ethyl]-3-methylpyrrolidine-2,5-dione
CID 164585890
CID 59941556
CID 59941556
(3S)-1-butyl-3-methylpyrrolidine-2,5-dione
CID 98085422
1-butyl-3-methylpyrrolidine-2,5-dione
CID 15757781
3-methyl-1-[2-[2-(3-oxobutoxy)ethoxy]ethyl]pyrrolidine-2,5-dione
CID 71056162
3-methyl-1-[2-[2-methyl-1-(4-oxopentan-2-yloxy)propan-2-yl]oxyethyl]pyrrolidine-2,5-dione
CID 139406493
3-(2-propan-2-yloxyethyl)imidazolidine-2,4-dione
CID 103601173
3-methyl-1-[2-(methylamino)ethyl]pyrrolidine-2,5-dione
CID 54496273
3-methyl-1-[2-[2-[(3-methyloxiran-2-yl)methoxy]ethoxy]ethyl]pyrrolidine-2,5-dione
CID 134408422
(3R)-1-[2-(4-chlorophenoxy)ethyl]-3-methylpyrrolidine-2,5-dione
CID 98280034

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(2-propan-2-yloxyethyl)pyrrolidine-2,5-dione?
The IUPAC name of 3-methyl-1-(2-propan-2-yloxyethyl)pyrrolidine-2,5-dione (CID 167490860) is 3-methyl-1-(2-propan-2-yloxyethyl)pyrrolidine-2,5-dione.
What is the SMILES notation for 3-methyl-1-(2-propan-2-yloxyethyl)pyrrolidine-2,5-dione?
The canonical SMILES for 3-methyl-1-(2-propan-2-yloxyethyl)pyrrolidine-2,5-dione is CC(C)OCCN1C(=O)CC(C)C1=O.
What is the InChIKey of 3-methyl-1-(2-propan-2-yloxyethyl)pyrrolidine-2,5-dione?
The InChIKey is WSVXONBHWKFFFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO3/c1-7(2)14-5-4-11-9(12)6-8(3)10(11)13/h7-8H,4-6H2,1-3H3.
What are the key properties of 3-methyl-1-(2-propan-2-yloxyethyl)pyrrolidine-2,5-dione?
3-methyl-1-(2-propan-2-yloxyethyl)pyrrolidine-2,5-dione has a molecular weight of 199.25 g/mol, XLogP of 0.81, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(2-propan-2-yloxyethyl)pyrrolidine-2,5-dione is sourced from PubChem (CID 167490860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).