4-(3-methyl-5-morpholin-4-ylphenyl)morpholin-3-one

C15H20N2O3 — CID 59817776

IUPAC4-(3-methyl-5-morpholin-4-ylphenyl)morpholin-3-one
SMILESCc1cc(N2CCOCC2)cc(N2CCOCC2=O)c1
InChIInChI=1S/C15H20N2O3/c1-12-8-13(16-2-5-19-6-3-16)10-14(9-12)17-4-7-20-11-15(17)18/h8-10H,2-7,11H2,1H3
InChIKeyCEYKYUPPKQNHKS-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.19
Rot. Bonds2

About 4-(3-methyl-5-morpholin-4-ylphenyl)morpholin-3-one

4-(3-methyl-5-morpholin-4-ylphenyl)morpholin-3-one (PubChem CID 59817776) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is 4-(3-methyl-5-morpholin-4-ylphenyl)morpholin-3-one.

Molecular Properties

Compound Name4-(3-methyl-5-morpholin-4-ylphenyl)morpholin-3-one
PubChem CID59817776
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC Name4-(3-methyl-5-morpholin-4-ylphenyl)morpholin-3-one
SMILESCc1cc(N2CCOCC2)cc(N2CCOCC2=O)c1
InChIInChI=1S/C15H20N2O3/c1-12-8-13(16-2-5-19-6-3-16)10-14(9-12)17-4-7-20-11-15(17)18/h8-10H,2-7,11H2,1H3
InChIKeyCEYKYUPPKQNHKS-UHFFFAOYSA-N
XLogP1.19
TPSA42.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(3-methyl-5-morpholin-4-ylphenyl)morpholin-3-one?
The IUPAC name of 4-(3-methyl-5-morpholin-4-ylphenyl)morpholin-3-one (CID 59817776) is 4-(3-methyl-5-morpholin-4-ylphenyl)morpholin-3-one.
What is the SMILES notation for 4-(3-methyl-5-morpholin-4-ylphenyl)morpholin-3-one?
The canonical SMILES for 4-(3-methyl-5-morpholin-4-ylphenyl)morpholin-3-one is Cc1cc(N2CCOCC2)cc(N2CCOCC2=O)c1.
What is the InChIKey of 4-(3-methyl-5-morpholin-4-ylphenyl)morpholin-3-one?
The InChIKey is CEYKYUPPKQNHKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-12-8-13(16-2-5-19-6-3-16)10-14(9-12)17-4-7-20-11-15(17)18/h8-10H,2-7,11H2,1H3.
What are the key properties of 4-(3-methyl-5-morpholin-4-ylphenyl)morpholin-3-one?
4-(3-methyl-5-morpholin-4-ylphenyl)morpholin-3-one has a molecular weight of 276.34 g/mol, XLogP of 1.19, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methyl-5-morpholin-4-ylphenyl)morpholin-3-one is sourced from PubChem (CID 59817776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).