5-methoxy-2-[2-(2-phenylethyl)morpholine-4-carbonyl]-1H-pyridin-4-one

C19H22N2O4 — CID 56873403

IUPAC5-methoxy-2-[2-(2-phenylethyl)morpholine-4-carbonyl]-1H-pyridin-4-one
SMILESCOc1c[nH]c(C(=O)N2CCOC(CCc3ccccc3)C2)cc1=O
InChIInChI=1S/C19H22N2O4/c1-24-18-12-20-16(11-17(18)22)19(23)21-9-10-25-15(13-21)8-7-14-5-3-2-4-6-14/h2-6,11-12,15H,7-10,13H2,1H3,(H,20,22)
InChIKeyMFFGSIAWXHSFQM-UHFFFAOYSA-N
MW342.40 g/mol
LogP1.86
Rot. Bonds5

About 5-methoxy-2-[2-(2-phenylethyl)morpholine-4-carbonyl]-1H-pyridin-4-one

5-methoxy-2-[2-(2-phenylethyl)morpholine-4-carbonyl]-1H-pyridin-4-one (PubChem CID 56873403) has the molecular formula C19H22N2O4 and a molecular weight of 342.40 g/mol. Its IUPAC name is 5-methoxy-2-[2-(2-phenylethyl)morpholine-4-carbonyl]-1H-pyridin-4-one.

Molecular Properties

Compound Name5-methoxy-2-[2-(2-phenylethyl)morpholine-4-carbonyl]-1H-pyridin-4-one
PubChem CID56873403
Molecular FormulaC19H22N2O4
Molecular Weight342.40 g/mol
Exact Mass342.16
IUPAC Name5-methoxy-2-[2-(2-phenylethyl)morpholine-4-carbonyl]-1H-pyridin-4-one
SMILESCOc1c[nH]c(C(=O)N2CCOC(CCc3ccccc3)C2)cc1=O
InChIInChI=1S/C19H22N2O4/c1-24-18-12-20-16(11-17(18)22)19(23)21-9-10-25-15(13-21)8-7-14-5-3-2-4-6-14/h2-6,11-12,15H,7-10,13H2,1H3,(H,20,22)
InChIKeyMFFGSIAWXHSFQM-UHFFFAOYSA-N
XLogP1.86
TPSA71.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2-[2-(2-phenylethyl)morpholine-4-carbonyl]-1H-pyridin-4-one?
The IUPAC name of 5-methoxy-2-[2-(2-phenylethyl)morpholine-4-carbonyl]-1H-pyridin-4-one (CID 56873403) is 5-methoxy-2-[2-(2-phenylethyl)morpholine-4-carbonyl]-1H-pyridin-4-one.
What is the SMILES notation for 5-methoxy-2-[2-(2-phenylethyl)morpholine-4-carbonyl]-1H-pyridin-4-one?
The canonical SMILES for 5-methoxy-2-[2-(2-phenylethyl)morpholine-4-carbonyl]-1H-pyridin-4-one is COc1c[nH]c(C(=O)N2CCOC(CCc3ccccc3)C2)cc1=O.
What is the InChIKey of 5-methoxy-2-[2-(2-phenylethyl)morpholine-4-carbonyl]-1H-pyridin-4-one?
The InChIKey is MFFGSIAWXHSFQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4/c1-24-18-12-20-16(11-17(18)22)19(23)21-9-10-25-15(13-21)8-7-14-5-3-2-4-6-14/h2-6,11-12,15H,7-10,13H2,1H3,(H,20,22).
What are the key properties of 5-methoxy-2-[2-(2-phenylethyl)morpholine-4-carbonyl]-1H-pyridin-4-one?
5-methoxy-2-[2-(2-phenylethyl)morpholine-4-carbonyl]-1H-pyridin-4-one has a molecular weight of 342.40 g/mol, XLogP of 1.86, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-[2-(2-phenylethyl)morpholine-4-carbonyl]-1H-pyridin-4-one is sourced from PubChem (CID 56873403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).