5-(2,5-dimethylphenyl)-1-methyl-3-morpholin-4-ylpyridin-2-one

C18H22N2O2 — CID 123391037

IUPAC5-(2,5-dimethylphenyl)-1-methyl-3-morpholin-4-ylpyridin-2-one
SMILESCc1ccc(C)c(-c2cc(N3CCOCC3)c(=O)n(C)c2)c1
InChIInChI=1S/C18H22N2O2/c1-13-4-5-14(2)16(10-13)15-11-17(18(21)19(3)12-15)20-6-8-22-9-7-20/h4-5,10-12H,6-9H2,1-3H3
InChIKeyWUKLBVUIAWZMFS-UHFFFAOYSA-N
MW298.39 g/mol
LogP2.51
Rot. Bonds2

About 5-(2,5-dimethylphenyl)-1-methyl-3-morpholin-4-ylpyridin-2-one

5-(2,5-dimethylphenyl)-1-methyl-3-morpholin-4-ylpyridin-2-one (PubChem CID 123391037) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is 5-(2,5-dimethylphenyl)-1-methyl-3-morpholin-4-ylpyridin-2-one.

Molecular Properties

Compound Name5-(2,5-dimethylphenyl)-1-methyl-3-morpholin-4-ylpyridin-2-one
PubChem CID123391037
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC Name5-(2,5-dimethylphenyl)-1-methyl-3-morpholin-4-ylpyridin-2-one
SMILESCc1ccc(C)c(-c2cc(N3CCOCC3)c(=O)n(C)c2)c1
InChIInChI=1S/C18H22N2O2/c1-13-4-5-14(2)16(10-13)15-11-17(18(21)19(3)12-15)20-6-8-22-9-7-20/h4-5,10-12H,6-9H2,1-3H3
InChIKeyWUKLBVUIAWZMFS-UHFFFAOYSA-N
XLogP2.51
TPSA34.47 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-methyl-3-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)phenyl]-5-propan-2-yl-1,2-oxazole-3-carboxamide
CID 90461181
5-[5-(dimethylamino)-2-fluorophenyl]-1-methyl-3-morpholin-4-ylpyridin-2-one
CID 134379343
2-[3-[[4-methyl-3-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)phenyl]carbamoyl]-5-(trifluoromethyl)phenyl]propan-2-ylcarbamic acid
CID 90456253
3-[(dimethylamino)methyl]-N-[4-methyl-3-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)phenyl]-5-(trifluoromethyl)benzamide
CID 90407957
4-(1,2-dihydroxyethyl)-N-[4-methyl-3-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)phenyl]-3-(trifluoromethyl)benzamide
CID 90456400
(E)-2-[(Z)-2-(methylideneamino)-2-[methyl-[2-(methylamino)ethyl]amino]ethenyl]-N-[4-methyl-3-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)phenyl]but-2-enamide
CID 130425629
4-[2-(furan-2-yl)-4-methylphenyl]morpholine
CID 168526395
1-methyl-2-(4-methylphenyl)-4-morpholin-4-ylpyridazine-3,6-dione
CID 91085632
5-methyl-2-morpholin-4-ylisoindole-1,3-dione
CID 70638046
5-methyl-2-morpholin-4-ylaniline
CID 18952141
1-(2,5-dimethylphenyl)-3-(4-methylphenyl)-4-morpholin-4-ylpyrrole-2,5-dione
CID 110573778
5-methyl-2-morpholin-4-ylbenzoic acid
CID 62516703

Frequently Asked Questions

What is the IUPAC name of 5-(2,5-dimethylphenyl)-1-methyl-3-morpholin-4-ylpyridin-2-one?
The IUPAC name of 5-(2,5-dimethylphenyl)-1-methyl-3-morpholin-4-ylpyridin-2-one (CID 123391037) is 5-(2,5-dimethylphenyl)-1-methyl-3-morpholin-4-ylpyridin-2-one.
What is the SMILES notation for 5-(2,5-dimethylphenyl)-1-methyl-3-morpholin-4-ylpyridin-2-one?
The canonical SMILES for 5-(2,5-dimethylphenyl)-1-methyl-3-morpholin-4-ylpyridin-2-one is Cc1ccc(C)c(-c2cc(N3CCOCC3)c(=O)n(C)c2)c1.
What is the InChIKey of 5-(2,5-dimethylphenyl)-1-methyl-3-morpholin-4-ylpyridin-2-one?
The InChIKey is WUKLBVUIAWZMFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2/c1-13-4-5-14(2)16(10-13)15-11-17(18(21)19(3)12-15)20-6-8-22-9-7-20/h4-5,10-12H,6-9H2,1-3H3.
What are the key properties of 5-(2,5-dimethylphenyl)-1-methyl-3-morpholin-4-ylpyridin-2-one?
5-(2,5-dimethylphenyl)-1-methyl-3-morpholin-4-ylpyridin-2-one has a molecular weight of 298.39 g/mol, XLogP of 2.51, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,5-dimethylphenyl)-1-methyl-3-morpholin-4-ylpyridin-2-one is sourced from PubChem (CID 123391037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).