4-pyrrolidin-2-ylmorpholin-2-one

C8H14N2O2 — CID 112546318

IUPAC4-pyrrolidin-2-ylmorpholin-2-one
SMILESO=C1CN(C2CCCN2)CCO1
InChIInChI=1S/C8H14N2O2/c11-8-6-10(4-5-12-8)7-2-1-3-9-7/h7,9H,1-6H2
InChIKeyKFJKNLFPUNGMNV-UHFFFAOYSA-N
MW170.21 g/mol
LogP-0.45
Rot. Bonds1

About 4-pyrrolidin-2-ylmorpholin-2-one

4-pyrrolidin-2-ylmorpholin-2-one (PubChem CID 112546318) has the molecular formula C8H14N2O2 and a molecular weight of 170.21 g/mol. Its IUPAC name is 4-pyrrolidin-2-ylmorpholin-2-one.

Molecular Properties

Compound Name4-pyrrolidin-2-ylmorpholin-2-one
PubChem CID112546318
Molecular FormulaC8H14N2O2
Molecular Weight170.21 g/mol
Exact Mass170.11
IUPAC Name4-pyrrolidin-2-ylmorpholin-2-one
SMILESO=C1CN(C2CCCN2)CCO1
InChIInChI=1S/C8H14N2O2/c11-8-6-10(4-5-12-8)7-2-1-3-9-7/h7,9H,1-6H2
InChIKeyKFJKNLFPUNGMNV-UHFFFAOYSA-N
XLogP-0.45
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.21
LogP ≤ 5-0.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-pyrrolidin-2-ylmorpholin-2-one?
The IUPAC name of 4-pyrrolidin-2-ylmorpholin-2-one (CID 112546318) is 4-pyrrolidin-2-ylmorpholin-2-one.
What is the SMILES notation for 4-pyrrolidin-2-ylmorpholin-2-one?
The canonical SMILES for 4-pyrrolidin-2-ylmorpholin-2-one is O=C1CN(C2CCCN2)CCO1.
What is the InChIKey of 4-pyrrolidin-2-ylmorpholin-2-one?
The InChIKey is KFJKNLFPUNGMNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O2/c11-8-6-10(4-5-12-8)7-2-1-3-9-7/h7,9H,1-6H2.
What are the key properties of 4-pyrrolidin-2-ylmorpholin-2-one?
4-pyrrolidin-2-ylmorpholin-2-one has a molecular weight of 170.21 g/mol, XLogP of -0.45, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pyrrolidin-2-ylmorpholin-2-one is sourced from PubChem (CID 112546318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).