3-methyl-1-[(3-methylpiperidin-2-yl)methyl]-3-propan-2-ylpyrrolidine-2,5-dione

C15H26N2O2 — CID 63305856

IUPAC3-methyl-1-[(3-methylpiperidin-2-yl)methyl]-3-propan-2-ylpyrrolidine-2,5-dione
SMILESCC1CCCNC1CN1C(=O)CC(C)(C(C)C)C1=O
InChIInChI=1S/C15H26N2O2/c1-10(2)15(4)8-13(18)17(14(15)19)9-12-11(3)6-5-7-16-12/h10-12,16H,5-9H2,1-4H3
InChIKeyIGGFTXFWHVIBLU-UHFFFAOYSA-N
MW266.38 g/mol
LogP1.80
Rot. Bonds3

About 3-methyl-1-[(3-methylpiperidin-2-yl)methyl]-3-propan-2-ylpyrrolidine-2,5-dione

3-methyl-1-[(3-methylpiperidin-2-yl)methyl]-3-propan-2-ylpyrrolidine-2,5-dione (PubChem CID 63305856) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 3-methyl-1-[(3-methylpiperidin-2-yl)methyl]-3-propan-2-ylpyrrolidine-2,5-dione.

Molecular Properties

Compound Name3-methyl-1-[(3-methylpiperidin-2-yl)methyl]-3-propan-2-ylpyrrolidine-2,5-dione
PubChem CID63305856
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name3-methyl-1-[(3-methylpiperidin-2-yl)methyl]-3-propan-2-ylpyrrolidine-2,5-dione
SMILESCC1CCCNC1CN1C(=O)CC(C)(C(C)C)C1=O
InChIInChI=1S/C15H26N2O2/c1-10(2)15(4)8-13(18)17(14(15)19)9-12-11(3)6-5-7-16-12/h10-12,16H,5-9H2,1-4H3
InChIKeyIGGFTXFWHVIBLU-UHFFFAOYSA-N
XLogP1.80
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-[(3-methylpiperidin-2-yl)methyl]-3-propan-2-ylpyrrolidine-2,5-dione?
The IUPAC name of 3-methyl-1-[(3-methylpiperidin-2-yl)methyl]-3-propan-2-ylpyrrolidine-2,5-dione (CID 63305856) is 3-methyl-1-[(3-methylpiperidin-2-yl)methyl]-3-propan-2-ylpyrrolidine-2,5-dione.
What is the SMILES notation for 3-methyl-1-[(3-methylpiperidin-2-yl)methyl]-3-propan-2-ylpyrrolidine-2,5-dione?
The canonical SMILES for 3-methyl-1-[(3-methylpiperidin-2-yl)methyl]-3-propan-2-ylpyrrolidine-2,5-dione is CC1CCCNC1CN1C(=O)CC(C)(C(C)C)C1=O.
What is the InChIKey of 3-methyl-1-[(3-methylpiperidin-2-yl)methyl]-3-propan-2-ylpyrrolidine-2,5-dione?
The InChIKey is IGGFTXFWHVIBLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-10(2)15(4)8-13(18)17(14(15)19)9-12-11(3)6-5-7-16-12/h10-12,16H,5-9H2,1-4H3.
What are the key properties of 3-methyl-1-[(3-methylpiperidin-2-yl)methyl]-3-propan-2-ylpyrrolidine-2,5-dione?
3-methyl-1-[(3-methylpiperidin-2-yl)methyl]-3-propan-2-ylpyrrolidine-2,5-dione has a molecular weight of 266.38 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-[(3-methylpiperidin-2-yl)methyl]-3-propan-2-ylpyrrolidine-2,5-dione is sourced from PubChem (CID 63305856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).