2,6-dimethyl-4-[(5-phenyl-1,3-oxazol-2-yl)methyl]morpholine

C16H20N2O2 — CID 51072746

IUPAC2,6-dimethyl-4-[(5-phenyl-1,3-oxazol-2-yl)methyl]morpholine
SMILESCC1CN(Cc2ncc(-c3ccccc3)o2)CC(C)O1
InChIInChI=1S/C16H20N2O2/c1-12-9-18(10-13(2)19-12)11-16-17-8-15(20-16)14-6-4-3-5-7-14/h3-8,12-13H,9-11H2,1-2H3
InChIKeyZCGVQDDUTMYMFS-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.95
Rot. Bonds3

About 2,6-dimethyl-4-[(5-phenyl-1,3-oxazol-2-yl)methyl]morpholine

2,6-dimethyl-4-[(5-phenyl-1,3-oxazol-2-yl)methyl]morpholine (PubChem CID 51072746) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 2,6-dimethyl-4-[(5-phenyl-1,3-oxazol-2-yl)methyl]morpholine.

Molecular Properties

Compound Name2,6-dimethyl-4-[(5-phenyl-1,3-oxazol-2-yl)methyl]morpholine
PubChem CID51072746
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name2,6-dimethyl-4-[(5-phenyl-1,3-oxazol-2-yl)methyl]morpholine
SMILESCC1CN(Cc2ncc(-c3ccccc3)o2)CC(C)O1
InChIInChI=1S/C16H20N2O2/c1-12-9-18(10-13(2)19-12)11-16-17-8-15(20-16)14-6-4-3-5-7-14/h3-8,12-13H,9-11H2,1-2H3
InChIKeyZCGVQDDUTMYMFS-UHFFFAOYSA-N
XLogP2.95
TPSA38.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-[(5-phenyl-1,3-oxazol-2-yl)methyl]morpholine?
The IUPAC name of 2,6-dimethyl-4-[(5-phenyl-1,3-oxazol-2-yl)methyl]morpholine (CID 51072746) is 2,6-dimethyl-4-[(5-phenyl-1,3-oxazol-2-yl)methyl]morpholine.
What is the SMILES notation for 2,6-dimethyl-4-[(5-phenyl-1,3-oxazol-2-yl)methyl]morpholine?
The canonical SMILES for 2,6-dimethyl-4-[(5-phenyl-1,3-oxazol-2-yl)methyl]morpholine is CC1CN(Cc2ncc(-c3ccccc3)o2)CC(C)O1.
What is the InChIKey of 2,6-dimethyl-4-[(5-phenyl-1,3-oxazol-2-yl)methyl]morpholine?
The InChIKey is ZCGVQDDUTMYMFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-12-9-18(10-13(2)19-12)11-16-17-8-15(20-16)14-6-4-3-5-7-14/h3-8,12-13H,9-11H2,1-2H3.
What are the key properties of 2,6-dimethyl-4-[(5-phenyl-1,3-oxazol-2-yl)methyl]morpholine?
2,6-dimethyl-4-[(5-phenyl-1,3-oxazol-2-yl)methyl]morpholine has a molecular weight of 272.35 g/mol, XLogP of 2.95, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4-[(5-phenyl-1,3-oxazol-2-yl)methyl]morpholine is sourced from PubChem (CID 51072746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).