5,5-dimethyl-1-[4-(1-methylpyrrolidin-3-yl)butanoyl]pyrrolidin-3-one

C15H26N2O2 — CID 115275617

IUPAC5,5-dimethyl-1-[4-(1-methylpyrrolidin-3-yl)butanoyl]pyrrolidin-3-one
SMILESCN1CCC(CCCC(=O)N2CC(=O)CC2(C)C)C1
InChIInChI=1S/C15H26N2O2/c1-15(2)9-13(18)11-17(15)14(19)6-4-5-12-7-8-16(3)10-12/h12H,4-11H2,1-3H3
InChIKeySWTFUXATOHUFDQ-UHFFFAOYSA-N
MW266.38 g/mol
LogP1.69
Rot. Bonds4

About 5,5-dimethyl-1-[4-(1-methylpyrrolidin-3-yl)butanoyl]pyrrolidin-3-one

5,5-dimethyl-1-[4-(1-methylpyrrolidin-3-yl)butanoyl]pyrrolidin-3-one (PubChem CID 115275617) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 5,5-dimethyl-1-[4-(1-methylpyrrolidin-3-yl)butanoyl]pyrrolidin-3-one.

Molecular Properties

Compound Name5,5-dimethyl-1-[4-(1-methylpyrrolidin-3-yl)butanoyl]pyrrolidin-3-one
PubChem CID115275617
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name5,5-dimethyl-1-[4-(1-methylpyrrolidin-3-yl)butanoyl]pyrrolidin-3-one
SMILESCN1CCC(CCCC(=O)N2CC(=O)CC2(C)C)C1
InChIInChI=1S/C15H26N2O2/c1-15(2)9-13(18)11-17(15)14(19)6-4-5-12-7-8-16(3)10-12/h12H,4-11H2,1-3H3
InChIKeySWTFUXATOHUFDQ-UHFFFAOYSA-N
XLogP1.69
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 5,5-dimethyl-1-[4-(1-methylpyrrolidin-3-yl)butanoyl]pyrrolidin-3-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(4-cyclopentylbutanoyl)-6,6-dimethylpiperidin-3-one
CID 115276326
6,6-dimethyl-1-[2-(1-methylpiperidin-4-yl)acetyl]piperidin-3-one
CID 115276298
1-(4-amino-2,2-dimethylpyrrolidin-1-yl)-4-cyclopentylbutan-1-one
CID 115275751
1-(3,3-dimethylbutanoyl)-5,5-dimethylpyrrolidin-3-one
CID 115275541
2,2-dimethyl-4-oxopyrrolidine-1-carboxamide
CID 146082191
N-methyl-4-(1-methylpyrrolidin-3-yl)butanehydrazide
CID 116845186
1-(4-hydroxy-2,2-dimethylpyrrolidin-1-yl)-3-(1-methylpiperidin-4-yl)propan-1-one
CID 115275458
4-(1-methylpyrrolidin-3-yl)butane-1-sulfonic acid
CID 87059945
1-(2,2-dimethylpiperazin-1-yl)-3-(1-methylpiperidin-4-yl)propan-1-one
CID 115273158
5-[methyl-[2-(1-methylpyrrolidin-3-yl)ethyl]amino]pentan-2-one
CID 115236802
5-(2,2-dimethyl-4-oxopyrrolidin-1-yl)pentanoic acid
CID 163404270
1-(4-aminopiperazin-1-yl)-3-(1-methylpyrrolidin-3-yl)propan-1-one
CID 167474650

Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-1-[4-(1-methylpyrrolidin-3-yl)butanoyl]pyrrolidin-3-one?
The IUPAC name of 5,5-dimethyl-1-[4-(1-methylpyrrolidin-3-yl)butanoyl]pyrrolidin-3-one (CID 115275617) is 5,5-dimethyl-1-[4-(1-methylpyrrolidin-3-yl)butanoyl]pyrrolidin-3-one.
What is the SMILES notation for 5,5-dimethyl-1-[4-(1-methylpyrrolidin-3-yl)butanoyl]pyrrolidin-3-one?
The canonical SMILES for 5,5-dimethyl-1-[4-(1-methylpyrrolidin-3-yl)butanoyl]pyrrolidin-3-one is CN1CCC(CCCC(=O)N2CC(=O)CC2(C)C)C1.
What is the InChIKey of 5,5-dimethyl-1-[4-(1-methylpyrrolidin-3-yl)butanoyl]pyrrolidin-3-one?
The InChIKey is SWTFUXATOHUFDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-15(2)9-13(18)11-17(15)14(19)6-4-5-12-7-8-16(3)10-12/h12H,4-11H2,1-3H3.
What are the key properties of 5,5-dimethyl-1-[4-(1-methylpyrrolidin-3-yl)butanoyl]pyrrolidin-3-one?
5,5-dimethyl-1-[4-(1-methylpyrrolidin-3-yl)butanoyl]pyrrolidin-3-one has a molecular weight of 266.38 g/mol, XLogP of 1.69, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-1-[4-(1-methylpyrrolidin-3-yl)butanoyl]pyrrolidin-3-one is sourced from PubChem (CID 115275617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).