3,4-diphenylmorpholine

C16H17NO — CID 22413504

IUPAC3,4-diphenylmorpholine
SMILESc1ccc(C2COCCN2c2ccccc2)cc1
InChIInChI=1S/C16H17NO/c1-3-7-14(8-4-1)16-13-18-12-11-17(16)15-9-5-2-6-10-15/h1-10,16H,11-13H2
InChIKeyGVUTXXITQVPMAA-UHFFFAOYSA-N
MW239.32 g/mol
LogP3.26
Rot. Bonds2

About 3,4-diphenylmorpholine

3,4-diphenylmorpholine (PubChem CID 22413504) has the molecular formula C16H17NO and a molecular weight of 239.32 g/mol. Its IUPAC name is 3,4-diphenylmorpholine.

Molecular Properties

Compound Name3,4-diphenylmorpholine
PubChem CID22413504
Molecular FormulaC16H17NO
Molecular Weight239.32 g/mol
Exact Mass239.13
IUPAC Name3,4-diphenylmorpholine
SMILESc1ccc(C2COCCN2c2ccccc2)cc1
InChIInChI=1S/C16H17NO/c1-3-7-14(8-4-1)16-13-18-12-11-17(16)15-9-5-2-6-10-15/h1-10,16H,11-13H2
InChIKeyGVUTXXITQVPMAA-UHFFFAOYSA-N
XLogP3.26
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,4-diphenylmorpholine?
The IUPAC name of 3,4-diphenylmorpholine (CID 22413504) is 3,4-diphenylmorpholine.
What is the SMILES notation for 3,4-diphenylmorpholine?
The canonical SMILES for 3,4-diphenylmorpholine is c1ccc(C2COCCN2c2ccccc2)cc1.
What is the InChIKey of 3,4-diphenylmorpholine?
The InChIKey is GVUTXXITQVPMAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO/c1-3-7-14(8-4-1)16-13-18-12-11-17(16)15-9-5-2-6-10-15/h1-10,16H,11-13H2.
What are the key properties of 3,4-diphenylmorpholine?
3,4-diphenylmorpholine has a molecular weight of 239.32 g/mol, XLogP of 3.26, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-diphenylmorpholine is sourced from PubChem (CID 22413504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).