4-methyl-1-[2-[(2S,5R)-2-methyl-5-phenylmorpholin-4-yl]-2-oxoethyl]pyridin-2-one

C19H22N2O3 — CID 124627784

IUPAC4-methyl-1-[2-[(2S,5R)-2-methyl-5-phenylmorpholin-4-yl]-2-oxoethyl]pyridin-2-one
SMILESCc1ccn(CC(=O)N2C[C@H](C)OC[C@H]2c2ccccc2)c(=O)c1
InChIInChI=1S/C19H22N2O3/c1-14-8-9-20(18(22)10-14)12-19(23)21-11-15(2)24-13-17(21)16-6-4-3-5-7-16/h3-10,15,17H,11-13H2,1-2H3/t15-,17-/m0/s1
InChIKeyLEYMGRLUOMJQMB-RDJZCZTQSA-N
MW326.40 g/mol
LogP2.15
Rot. Bonds3

About 4-methyl-1-[2-[(2S,5R)-2-methyl-5-phenylmorpholin-4-yl]-2-oxoethyl]pyridin-2-one

4-methyl-1-[2-[(2S,5R)-2-methyl-5-phenylmorpholin-4-yl]-2-oxoethyl]pyridin-2-one (PubChem CID 124627784) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is 4-methyl-1-[2-[(2S,5R)-2-methyl-5-phenylmorpholin-4-yl]-2-oxoethyl]pyridin-2-one.

Molecular Properties

Compound Name4-methyl-1-[2-[(2S,5R)-2-methyl-5-phenylmorpholin-4-yl]-2-oxoethyl]pyridin-2-one
PubChem CID124627784
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC Name4-methyl-1-[2-[(2S,5R)-2-methyl-5-phenylmorpholin-4-yl]-2-oxoethyl]pyridin-2-one
SMILESCc1ccn(CC(=O)N2C[C@H](C)OC[C@H]2c2ccccc2)c(=O)c1
InChIInChI=1S/C19H22N2O3/c1-14-8-9-20(18(22)10-14)12-19(23)21-11-15(2)24-13-17(21)16-6-4-3-5-7-16/h3-10,15,17H,11-13H2,1-2H3/t15-,17-/m0/s1
InChIKeyLEYMGRLUOMJQMB-RDJZCZTQSA-N
XLogP2.15
TPSA51.54 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-[2-[(2S,5R)-2-methyl-5-phenylmorpholin-4-yl]-2-oxoethyl]pyridin-2-one?
The IUPAC name of 4-methyl-1-[2-[(2S,5R)-2-methyl-5-phenylmorpholin-4-yl]-2-oxoethyl]pyridin-2-one (CID 124627784) is 4-methyl-1-[2-[(2S,5R)-2-methyl-5-phenylmorpholin-4-yl]-2-oxoethyl]pyridin-2-one.
What is the SMILES notation for 4-methyl-1-[2-[(2S,5R)-2-methyl-5-phenylmorpholin-4-yl]-2-oxoethyl]pyridin-2-one?
The canonical SMILES for 4-methyl-1-[2-[(2S,5R)-2-methyl-5-phenylmorpholin-4-yl]-2-oxoethyl]pyridin-2-one is Cc1ccn(CC(=O)N2C[C@H](C)OC[C@H]2c2ccccc2)c(=O)c1.
What is the InChIKey of 4-methyl-1-[2-[(2S,5R)-2-methyl-5-phenylmorpholin-4-yl]-2-oxoethyl]pyridin-2-one?
The InChIKey is LEYMGRLUOMJQMB-RDJZCZTQSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-14-8-9-20(18(22)10-14)12-19(23)21-11-15(2)24-13-17(21)16-6-4-3-5-7-16/h3-10,15,17H,11-13H2,1-2H3/t15-,17-/m0/s1.
What are the key properties of 4-methyl-1-[2-[(2S,5R)-2-methyl-5-phenylmorpholin-4-yl]-2-oxoethyl]pyridin-2-one?
4-methyl-1-[2-[(2S,5R)-2-methyl-5-phenylmorpholin-4-yl]-2-oxoethyl]pyridin-2-one has a molecular weight of 326.40 g/mol, XLogP of 2.15, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-[2-[(2S,5R)-2-methyl-5-phenylmorpholin-4-yl]-2-oxoethyl]pyridin-2-one is sourced from PubChem (CID 124627784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).