2,2-dimethyl-1-(1-methylpyrrolidine-3-carbonyl)pyrrolidin-3-one

C12H20N2O2 — CID 115275141

IUPAC2,2-dimethyl-1-(1-methylpyrrolidine-3-carbonyl)pyrrolidin-3-one
SMILESCN1CCC(C(=O)N2CCC(=O)C2(C)C)C1
InChIInChI=1S/C12H20N2O2/c1-12(2)10(15)5-7-14(12)11(16)9-4-6-13(3)8-9/h9H,4-8H2,1-3H3
InChIKeyDLOIFXAHZQVTLB-UHFFFAOYSA-N
MW224.30 g/mol
LogP0.52
Rot. Bonds1

About 2,2-dimethyl-1-(1-methylpyrrolidine-3-carbonyl)pyrrolidin-3-one

2,2-dimethyl-1-(1-methylpyrrolidine-3-carbonyl)pyrrolidin-3-one (PubChem CID 115275141) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is 2,2-dimethyl-1-(1-methylpyrrolidine-3-carbonyl)pyrrolidin-3-one.

Molecular Properties

Compound Name2,2-dimethyl-1-(1-methylpyrrolidine-3-carbonyl)pyrrolidin-3-one
PubChem CID115275141
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC Name2,2-dimethyl-1-(1-methylpyrrolidine-3-carbonyl)pyrrolidin-3-one
SMILESCN1CCC(C(=O)N2CCC(=O)C2(C)C)C1
InChIInChI=1S/C12H20N2O2/c1-12(2)10(15)5-7-14(12)11(16)9-4-6-13(3)8-9/h9H,4-8H2,1-3H3
InChIKeyDLOIFXAHZQVTLB-UHFFFAOYSA-N
XLogP0.52
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 50.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-1-(1-methylpyrrolidine-3-carbonyl)pyrrolidin-3-one?
The IUPAC name of 2,2-dimethyl-1-(1-methylpyrrolidine-3-carbonyl)pyrrolidin-3-one (CID 115275141) is 2,2-dimethyl-1-(1-methylpyrrolidine-3-carbonyl)pyrrolidin-3-one.
What is the SMILES notation for 2,2-dimethyl-1-(1-methylpyrrolidine-3-carbonyl)pyrrolidin-3-one?
The canonical SMILES for 2,2-dimethyl-1-(1-methylpyrrolidine-3-carbonyl)pyrrolidin-3-one is CN1CCC(C(=O)N2CCC(=O)C2(C)C)C1.
What is the InChIKey of 2,2-dimethyl-1-(1-methylpyrrolidine-3-carbonyl)pyrrolidin-3-one?
The InChIKey is DLOIFXAHZQVTLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-12(2)10(15)5-7-14(12)11(16)9-4-6-13(3)8-9/h9H,4-8H2,1-3H3.
What are the key properties of 2,2-dimethyl-1-(1-methylpyrrolidine-3-carbonyl)pyrrolidin-3-one?
2,2-dimethyl-1-(1-methylpyrrolidine-3-carbonyl)pyrrolidin-3-one has a molecular weight of 224.30 g/mol, XLogP of 0.52, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-1-(1-methylpyrrolidine-3-carbonyl)pyrrolidin-3-one is sourced from PubChem (CID 115275141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).