4-(2,6-diphenylpyrimidin-4-yl)morpholine

C20H19N3O — CID 656281

IUPAC4-(2,6-diphenylpyrimidin-4-yl)morpholine
SMILESc1ccc(-c2cc(N3CCOCC3)nc(-c3ccccc3)n2)cc1
InChIInChI=1S/C20H19N3O/c1-3-7-16(8-4-1)18-15-19(23-11-13-24-14-12-23)22-20(21-18)17-9-5-2-6-10-17/h1-10,15H,11-14H2
InChIKeyNHAXZOWPTAFHID-UHFFFAOYSA-N
MW317.39 g/mol
LogP3.65
Rot. Bonds3

About 4-(2,6-diphenylpyrimidin-4-yl)morpholine

4-(2,6-diphenylpyrimidin-4-yl)morpholine (PubChem CID 656281) has the molecular formula C20H19N3O and a molecular weight of 317.39 g/mol. Its IUPAC name is 4-(2,6-diphenylpyrimidin-4-yl)morpholine.

Molecular Properties

Compound Name4-(2,6-diphenylpyrimidin-4-yl)morpholine
PubChem CID656281
Molecular FormulaC20H19N3O
Molecular Weight317.39 g/mol
Exact Mass317.15
IUPAC Name4-(2,6-diphenylpyrimidin-4-yl)morpholine
SMILESc1ccc(-c2cc(N3CCOCC3)nc(-c3ccccc3)n2)cc1
InChIInChI=1S/C20H19N3O/c1-3-7-16(8-4-1)18-15-19(23-11-13-24-14-12-23)22-20(21-18)17-9-5-2-6-10-17/h1-10,15H,11-14H2
InChIKeyNHAXZOWPTAFHID-UHFFFAOYSA-N
XLogP3.65
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2,6-diphenylpyrimidin-4-yl)morpholine?
The IUPAC name of 4-(2,6-diphenylpyrimidin-4-yl)morpholine (CID 656281) is 4-(2,6-diphenylpyrimidin-4-yl)morpholine.
What is the SMILES notation for 4-(2,6-diphenylpyrimidin-4-yl)morpholine?
The canonical SMILES for 4-(2,6-diphenylpyrimidin-4-yl)morpholine is c1ccc(-c2cc(N3CCOCC3)nc(-c3ccccc3)n2)cc1.
What is the InChIKey of 4-(2,6-diphenylpyrimidin-4-yl)morpholine?
The InChIKey is NHAXZOWPTAFHID-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O/c1-3-7-16(8-4-1)18-15-19(23-11-13-24-14-12-23)22-20(21-18)17-9-5-2-6-10-17/h1-10,15H,11-14H2.
What are the key properties of 4-(2,6-diphenylpyrimidin-4-yl)morpholine?
4-(2,6-diphenylpyrimidin-4-yl)morpholine has a molecular weight of 317.39 g/mol, XLogP of 3.65, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-diphenylpyrimidin-4-yl)morpholine is sourced from PubChem (CID 656281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).