(3R)-3-methyl-3-propylpyrrolidine-2,5-dione

C8H13NO2 — CID 6998935

IUPAC(3R)-3-methyl-3-propylpyrrolidine-2,5-dione
SMILESCCC[C@]1(C)CC(=O)NC1=O
InChIInChI=1S/C8H13NO2/c1-3-4-8(2)5-6(10)9-7(8)11/h3-5H2,1-2H3,(H,9,10,11)/t8-/m1/s1
InChIKeyVXXGMHKGORIRTK-MRVPVSSYSA-N
MW155.20 g/mol
LogP0.84
Rot. Bonds2

About (3R)-3-methyl-3-propylpyrrolidine-2,5-dione

(3R)-3-methyl-3-propylpyrrolidine-2,5-dione (PubChem CID 6998935) has the molecular formula C8H13NO2 and a molecular weight of 155.20 g/mol. Its IUPAC name is (3R)-3-methyl-3-propylpyrrolidine-2,5-dione.

Molecular Properties

Compound Name(3R)-3-methyl-3-propylpyrrolidine-2,5-dione
PubChem CID6998935
Molecular FormulaC8H13NO2
Molecular Weight155.20 g/mol
Exact Mass155.09
IUPAC Name(3R)-3-methyl-3-propylpyrrolidine-2,5-dione
SMILESCCC[C@]1(C)CC(=O)NC1=O
InChIInChI=1S/C8H13NO2/c1-3-4-8(2)5-6(10)9-7(8)11/h3-5H2,1-2H3,(H,9,10,11)/t8-/m1/s1
InChIKeyVXXGMHKGORIRTK-MRVPVSSYSA-N
XLogP0.84
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Ethosuximide
CID 3291
2-Azaspiro[4.5]decane-1,3-dione
CID 279581
2-Azaspiro[4.4]nonane-1,3-dione
CID 4961799
(R)-Ethosuximide
CID 6603844
3-Ethyl-4-methylpyrrolidine-2,5-dione
CID 20033949
3,3-Diethylpyrrolidine-2,5-dione
CID 222690
(S)-Ethosuximide
CID 10630591
3-Methyl-3-propyl-2,5-pyrrolidinedione
CID 73899
6-Azaspiro(3.4)octane-5,7-dione
CID 15155
8-Methyl-2-azaspiro(4.5)decane-1,3-dione
CID 43155384
a-Methyl-a-ethyl succinimide
CID 18442688
3-Methyl-3-(2,2,2-trideuterioethyl)pyrrolidine-2,5-dione
CID 46781517

Frequently Asked Questions

What is the IUPAC name of (3R)-3-methyl-3-propylpyrrolidine-2,5-dione?
The IUPAC name of (3R)-3-methyl-3-propylpyrrolidine-2,5-dione (CID 6998935) is (3R)-3-methyl-3-propylpyrrolidine-2,5-dione.
What is the SMILES notation for (3R)-3-methyl-3-propylpyrrolidine-2,5-dione?
The canonical SMILES for (3R)-3-methyl-3-propylpyrrolidine-2,5-dione is CCC[C@]1(C)CC(=O)NC1=O.
What is the InChIKey of (3R)-3-methyl-3-propylpyrrolidine-2,5-dione?
The InChIKey is VXXGMHKGORIRTK-MRVPVSSYSA-N. The full InChI is InChI=1S/C8H13NO2/c1-3-4-8(2)5-6(10)9-7(8)11/h3-5H2,1-2H3,(H,9,10,11)/t8-/m1/s1.
What are the key properties of (3R)-3-methyl-3-propylpyrrolidine-2,5-dione?
(3R)-3-methyl-3-propylpyrrolidine-2,5-dione has a molecular weight of 155.20 g/mol, XLogP of 0.84, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-methyl-3-propylpyrrolidine-2,5-dione is sourced from PubChem (CID 6998935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).