4-pyrrolidin-3-ylmorpholine

C8H16N2O — CID 14627373

IUPAC4-pyrrolidin-3-ylmorpholine
SMILESC1CC(N2CCOCC2)CN1
InChIInChI=1S/C8H16N2O/c1-2-9-7-8(1)10-3-5-11-6-4-10/h8-9H,1-7H2
InChIKeyOPJDRNMJJNFSNZ-UHFFFAOYSA-N
MW156.23 g/mol
LogP-0.32
Rot. Bonds1

About 4-pyrrolidin-3-ylmorpholine

4-pyrrolidin-3-ylmorpholine (PubChem CID 14627373) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 4-pyrrolidin-3-ylmorpholine.

Molecular Properties

Compound Name4-pyrrolidin-3-ylmorpholine
PubChem CID14627373
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name4-pyrrolidin-3-ylmorpholine
SMILESC1CC(N2CCOCC2)CN1
InChIInChI=1S/C8H16N2O/c1-2-9-7-8(1)10-3-5-11-6-4-10/h8-9H,1-7H2
InChIKeyOPJDRNMJJNFSNZ-UHFFFAOYSA-N
XLogP-0.32
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 5-0.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-pyrrolidin-3-ylmorpholine?
The IUPAC name of 4-pyrrolidin-3-ylmorpholine (CID 14627373) is 4-pyrrolidin-3-ylmorpholine.
What is the SMILES notation for 4-pyrrolidin-3-ylmorpholine?
The canonical SMILES for 4-pyrrolidin-3-ylmorpholine is C1CC(N2CCOCC2)CN1.
What is the InChIKey of 4-pyrrolidin-3-ylmorpholine?
The InChIKey is OPJDRNMJJNFSNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-2-9-7-8(1)10-3-5-11-6-4-10/h8-9H,1-7H2.
What are the key properties of 4-pyrrolidin-3-ylmorpholine?
4-pyrrolidin-3-ylmorpholine has a molecular weight of 156.23 g/mol, XLogP of -0.32, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pyrrolidin-3-ylmorpholine is sourced from PubChem (CID 14627373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).