1-(1-propylazetidin-3-yl)pyrrolidine-2,5-dione

C10H16N2O2 — CID 121183852

IUPAC1-(1-propylazetidin-3-yl)pyrrolidine-2,5-dione
SMILESCCCN1CC(N2C(=O)CCC2=O)C1
InChIInChI=1S/C10H16N2O2/c1-2-5-11-6-8(7-11)12-9(13)3-4-10(12)14/h8H,2-7H2,1H3
InChIKeyRRFWRUQHASZVQA-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.23
Rot. Bonds3

About 1-(1-propylazetidin-3-yl)pyrrolidine-2,5-dione

1-(1-propylazetidin-3-yl)pyrrolidine-2,5-dione (PubChem CID 121183852) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 1-(1-propylazetidin-3-yl)pyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-(1-propylazetidin-3-yl)pyrrolidine-2,5-dione
PubChem CID121183852
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name1-(1-propylazetidin-3-yl)pyrrolidine-2,5-dione
SMILESCCCN1CC(N2C(=O)CCC2=O)C1
InChIInChI=1S/C10H16N2O2/c1-2-5-11-6-8(7-11)12-9(13)3-4-10(12)14/h8H,2-7H2,1H3
InChIKeyRRFWRUQHASZVQA-UHFFFAOYSA-N
XLogP0.23
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.23
H-Bond Donors ≤ 50
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 1-(1-propylazetidin-3-yl)pyrrolidine-2,5-dione?
The IUPAC name of 1-(1-propylazetidin-3-yl)pyrrolidine-2,5-dione (CID 121183852) is 1-(1-propylazetidin-3-yl)pyrrolidine-2,5-dione.
What is the SMILES notation for 1-(1-propylazetidin-3-yl)pyrrolidine-2,5-dione?
The canonical SMILES for 1-(1-propylazetidin-3-yl)pyrrolidine-2,5-dione is CCCN1CC(N2C(=O)CCC2=O)C1.
What is the InChIKey of 1-(1-propylazetidin-3-yl)pyrrolidine-2,5-dione?
The InChIKey is RRFWRUQHASZVQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-2-5-11-6-8(7-11)12-9(13)3-4-10(12)14/h8H,2-7H2,1H3.
What are the key properties of 1-(1-propylazetidin-3-yl)pyrrolidine-2,5-dione?
1-(1-propylazetidin-3-yl)pyrrolidine-2,5-dione has a molecular weight of 196.25 g/mol, XLogP of 0.23, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-propylazetidin-3-yl)pyrrolidine-2,5-dione is sourced from PubChem (CID 121183852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).