2,2-difluoro-1-[2-(morpholine-4-carbonyl)pyrrolidin-1-yl]ethanone

C11H16F2N2O3 — CID 103514734

IUPAC2,2-difluoro-1-[2-(morpholine-4-carbonyl)pyrrolidin-1-yl]ethanone
SMILESO=C(C1CCCN1C(=O)C(F)F)N1CCOCC1
InChIInChI=1S/C11H16F2N2O3/c12-9(13)11(17)15-3-1-2-8(15)10(16)14-4-6-18-7-5-14/h8-9H,1-7H2
InChIKeyUEXAJEBGBWIJHD-UHFFFAOYSA-N
MW262.26 g/mol
LogP0.10
Rot. Bonds2

About 2,2-difluoro-1-[2-(morpholine-4-carbonyl)pyrrolidin-1-yl]ethanone

2,2-difluoro-1-[2-(morpholine-4-carbonyl)pyrrolidin-1-yl]ethanone (PubChem CID 103514734) has the molecular formula C11H16F2N2O3 and a molecular weight of 262.26 g/mol. Its IUPAC name is 2,2-difluoro-1-[2-(morpholine-4-carbonyl)pyrrolidin-1-yl]ethanone.

Molecular Properties

Compound Name2,2-difluoro-1-[2-(morpholine-4-carbonyl)pyrrolidin-1-yl]ethanone
PubChem CID103514734
Molecular FormulaC11H16F2N2O3
Molecular Weight262.26 g/mol
Exact Mass262.11
IUPAC Name2,2-difluoro-1-[2-(morpholine-4-carbonyl)pyrrolidin-1-yl]ethanone
SMILESO=C(C1CCCN1C(=O)C(F)F)N1CCOCC1
InChIInChI=1S/C11H16F2N2O3/c12-9(13)11(17)15-3-1-2-8(15)10(16)14-4-6-18-7-5-14/h8-9H,1-7H2
InChIKeyUEXAJEBGBWIJHD-UHFFFAOYSA-N
XLogP0.10
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.26
LogP ≤ 50.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2,2-difluoro-1-[2-(morpholine-4-carbonyl)pyrrolidin-1-yl]ethanone with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-1-[2-(morpholine-4-carbonyl)pyrrolidin-1-yl]ethanone?
The IUPAC name of 2,2-difluoro-1-[2-(morpholine-4-carbonyl)pyrrolidin-1-yl]ethanone (CID 103514734) is 2,2-difluoro-1-[2-(morpholine-4-carbonyl)pyrrolidin-1-yl]ethanone.
What is the SMILES notation for 2,2-difluoro-1-[2-(morpholine-4-carbonyl)pyrrolidin-1-yl]ethanone?
The canonical SMILES for 2,2-difluoro-1-[2-(morpholine-4-carbonyl)pyrrolidin-1-yl]ethanone is O=C(C1CCCN1C(=O)C(F)F)N1CCOCC1.
What is the InChIKey of 2,2-difluoro-1-[2-(morpholine-4-carbonyl)pyrrolidin-1-yl]ethanone?
The InChIKey is UEXAJEBGBWIJHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16F2N2O3/c12-9(13)11(17)15-3-1-2-8(15)10(16)14-4-6-18-7-5-14/h8-9H,1-7H2.
What are the key properties of 2,2-difluoro-1-[2-(morpholine-4-carbonyl)pyrrolidin-1-yl]ethanone?
2,2-difluoro-1-[2-(morpholine-4-carbonyl)pyrrolidin-1-yl]ethanone has a molecular weight of 262.26 g/mol, XLogP of 0.10, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-1-[2-(morpholine-4-carbonyl)pyrrolidin-1-yl]ethanone is sourced from PubChem (CID 103514734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).