6-[phenoxy(phenyl)methyl]morpholin-3-one

C17H17NO3 — CID 18730286

IUPAC6-[phenoxy(phenyl)methyl]morpholin-3-one
SMILESO=C1COC(C(Oc2ccccc2)c2ccccc2)CN1
InChIInChI=1S/C17H17NO3/c19-16-12-20-15(11-18-16)17(13-7-3-1-4-8-13)21-14-9-5-2-6-10-14/h1-10,15,17H,11-12H2,(H,18,19)
InChIKeyDFVSNHVXAWMTHY-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.32
Rot. Bonds4

About 6-[phenoxy(phenyl)methyl]morpholin-3-one

6-[phenoxy(phenyl)methyl]morpholin-3-one (PubChem CID 18730286) has the molecular formula C17H17NO3 and a molecular weight of 283.33 g/mol. Its IUPAC name is 6-[phenoxy(phenyl)methyl]morpholin-3-one.

Molecular Properties

Compound Name6-[phenoxy(phenyl)methyl]morpholin-3-one
PubChem CID18730286
Molecular FormulaC17H17NO3
Molecular Weight283.33 g/mol
Exact Mass283.12
IUPAC Name6-[phenoxy(phenyl)methyl]morpholin-3-one
SMILESO=C1COC(C(Oc2ccccc2)c2ccccc2)CN1
InChIInChI=1S/C17H17NO3/c19-16-12-20-15(11-18-16)17(13-7-3-1-4-8-13)21-14-9-5-2-6-10-14/h1-10,15,17H,11-12H2,(H,18,19)
InChIKeyDFVSNHVXAWMTHY-UHFFFAOYSA-N
XLogP2.32
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-[phenoxy(phenyl)methyl]morpholin-3-one?
The IUPAC name of 6-[phenoxy(phenyl)methyl]morpholin-3-one (CID 18730286) is 6-[phenoxy(phenyl)methyl]morpholin-3-one.
What is the SMILES notation for 6-[phenoxy(phenyl)methyl]morpholin-3-one?
The canonical SMILES for 6-[phenoxy(phenyl)methyl]morpholin-3-one is O=C1COC(C(Oc2ccccc2)c2ccccc2)CN1.
What is the InChIKey of 6-[phenoxy(phenyl)methyl]morpholin-3-one?
The InChIKey is DFVSNHVXAWMTHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO3/c19-16-12-20-15(11-18-16)17(13-7-3-1-4-8-13)21-14-9-5-2-6-10-14/h1-10,15,17H,11-12H2,(H,18,19).
What are the key properties of 6-[phenoxy(phenyl)methyl]morpholin-3-one?
6-[phenoxy(phenyl)methyl]morpholin-3-one has a molecular weight of 283.33 g/mol, XLogP of 2.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[phenoxy(phenyl)methyl]morpholin-3-one is sourced from PubChem (CID 18730286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).