3-(2-pyrrolidin-1-ylphenyl)morpholine

C14H20N2O — CID 82619779

IUPAC3-(2-pyrrolidin-1-ylphenyl)morpholine
SMILESc1ccc(N2CCCC2)c(C2COCCN2)c1
InChIInChI=1S/C14H20N2O/c1-2-6-14(16-8-3-4-9-16)12(5-1)13-11-17-10-7-15-13/h1-2,5-6,13,15H,3-4,7-11H2
InChIKeyUANXQTQZCOAKOX-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.95
Rot. Bonds2

About 3-(2-pyrrolidin-1-ylphenyl)morpholine

3-(2-pyrrolidin-1-ylphenyl)morpholine (PubChem CID 82619779) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 3-(2-pyrrolidin-1-ylphenyl)morpholine.

Molecular Properties

Compound Name3-(2-pyrrolidin-1-ylphenyl)morpholine
PubChem CID82619779
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name3-(2-pyrrolidin-1-ylphenyl)morpholine
SMILESc1ccc(N2CCCC2)c(C2COCCN2)c1
InChIInChI=1S/C14H20N2O/c1-2-6-14(16-8-3-4-9-16)12(5-1)13-11-17-10-7-15-13/h1-2,5-6,13,15H,3-4,7-11H2
InChIKeyUANXQTQZCOAKOX-UHFFFAOYSA-N
XLogP1.95
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(2-pyrrolidin-1-ylphenyl)morpholine?
The IUPAC name of 3-(2-pyrrolidin-1-ylphenyl)morpholine (CID 82619779) is 3-(2-pyrrolidin-1-ylphenyl)morpholine.
What is the SMILES notation for 3-(2-pyrrolidin-1-ylphenyl)morpholine?
The canonical SMILES for 3-(2-pyrrolidin-1-ylphenyl)morpholine is c1ccc(N2CCCC2)c(C2COCCN2)c1.
What is the InChIKey of 3-(2-pyrrolidin-1-ylphenyl)morpholine?
The InChIKey is UANXQTQZCOAKOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-2-6-14(16-8-3-4-9-16)12(5-1)13-11-17-10-7-15-13/h1-2,5-6,13,15H,3-4,7-11H2.
What are the key properties of 3-(2-pyrrolidin-1-ylphenyl)morpholine?
3-(2-pyrrolidin-1-ylphenyl)morpholine has a molecular weight of 232.33 g/mol, XLogP of 1.95, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-pyrrolidin-1-ylphenyl)morpholine is sourced from PubChem (CID 82619779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).