5-methyl-1-[4-(2-morpholin-4-ylethoxy)phenyl]pyridin-2-one

C18H22N2O3 — CID 71543198

IUPAC5-methyl-1-[4-(2-morpholin-4-ylethoxy)phenyl]pyridin-2-one
SMILESCc1ccc(=O)n(-c2ccc(OCCN3CCOCC3)cc2)c1
InChIInChI=1S/C18H22N2O3/c1-15-2-7-18(21)20(14-15)16-3-5-17(6-4-16)23-13-10-19-8-11-22-12-9-19/h2-7,14H,8-13H2,1H3
InChIKeyGEAVSCDNWLQDOY-UHFFFAOYSA-N
MW314.39 g/mol
LogP1.86
Rot. Bonds5

About 5-methyl-1-[4-(2-morpholin-4-ylethoxy)phenyl]pyridin-2-one

5-methyl-1-[4-(2-morpholin-4-ylethoxy)phenyl]pyridin-2-one (PubChem CID 71543198) has the molecular formula C18H22N2O3 and a molecular weight of 314.39 g/mol. Its IUPAC name is 5-methyl-1-[4-(2-morpholin-4-ylethoxy)phenyl]pyridin-2-one.

Molecular Properties

Compound Name5-methyl-1-[4-(2-morpholin-4-ylethoxy)phenyl]pyridin-2-one
PubChem CID71543198
Molecular FormulaC18H22N2O3
Molecular Weight314.39 g/mol
Exact Mass314.16
IUPAC Name5-methyl-1-[4-(2-morpholin-4-ylethoxy)phenyl]pyridin-2-one
SMILESCc1ccc(=O)n(-c2ccc(OCCN3CCOCC3)cc2)c1
InChIInChI=1S/C18H22N2O3/c1-15-2-7-18(21)20(14-15)16-3-5-17(6-4-16)23-13-10-19-8-11-22-12-9-19/h2-7,14H,8-13H2,1H3
InChIKeyGEAVSCDNWLQDOY-UHFFFAOYSA-N
XLogP1.86
TPSA43.70 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.39
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-1-[4-(2-morpholin-4-ylethoxy)phenyl]pyridin-2-one?
The IUPAC name of 5-methyl-1-[4-(2-morpholin-4-ylethoxy)phenyl]pyridin-2-one (CID 71543198) is 5-methyl-1-[4-(2-morpholin-4-ylethoxy)phenyl]pyridin-2-one.
What is the SMILES notation for 5-methyl-1-[4-(2-morpholin-4-ylethoxy)phenyl]pyridin-2-one?
The canonical SMILES for 5-methyl-1-[4-(2-morpholin-4-ylethoxy)phenyl]pyridin-2-one is Cc1ccc(=O)n(-c2ccc(OCCN3CCOCC3)cc2)c1.
What is the InChIKey of 5-methyl-1-[4-(2-morpholin-4-ylethoxy)phenyl]pyridin-2-one?
The InChIKey is GEAVSCDNWLQDOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O3/c1-15-2-7-18(21)20(14-15)16-3-5-17(6-4-16)23-13-10-19-8-11-22-12-9-19/h2-7,14H,8-13H2,1H3.
What are the key properties of 5-methyl-1-[4-(2-morpholin-4-ylethoxy)phenyl]pyridin-2-one?
5-methyl-1-[4-(2-morpholin-4-ylethoxy)phenyl]pyridin-2-one has a molecular weight of 314.39 g/mol, XLogP of 1.86, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-[4-(2-morpholin-4-ylethoxy)phenyl]pyridin-2-one is sourced from PubChem (CID 71543198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).