2-(6,6-dimethyl-2-oxo-4-phenylmorpholin-3-yl)-N-(4-propan-2-ylphenyl)acetamide

C23H28N2O3 — CID 53244395

IUPAC2-(6,6-dimethyl-2-oxo-4-phenylmorpholin-3-yl)-N-(4-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccc(NC(=O)CC2C(=O)OC(C)(C)CN2c2ccccc2)cc1
InChIInChI=1S/C23H28N2O3/c1-16(2)17-10-12-18(13-11-17)24-21(26)14-20-22(27)28-23(3,4)15-25(20)19-8-6-5-7-9-19/h5-13,16,20H,14-15H2,1-4H3,(H,24,26)
InChIKeyRUVDUDDKTIEACQ-UHFFFAOYSA-N
MW380.49 g/mol
LogP4.35
Rot. Bonds5

About 2-(6,6-dimethyl-2-oxo-4-phenylmorpholin-3-yl)-N-(4-propan-2-ylphenyl)acetamide

2-(6,6-dimethyl-2-oxo-4-phenylmorpholin-3-yl)-N-(4-propan-2-ylphenyl)acetamide (PubChem CID 53244395) has the molecular formula C23H28N2O3 and a molecular weight of 380.49 g/mol. Its IUPAC name is 2-(6,6-dimethyl-2-oxo-4-phenylmorpholin-3-yl)-N-(4-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(6,6-dimethyl-2-oxo-4-phenylmorpholin-3-yl)-N-(4-propan-2-ylphenyl)acetamide
PubChem CID53244395
Molecular FormulaC23H28N2O3
Molecular Weight380.49 g/mol
Exact Mass380.21
IUPAC Name2-(6,6-dimethyl-2-oxo-4-phenylmorpholin-3-yl)-N-(4-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccc(NC(=O)CC2C(=O)OC(C)(C)CN2c2ccccc2)cc1
InChIInChI=1S/C23H28N2O3/c1-16(2)17-10-12-18(13-11-17)24-21(26)14-20-22(27)28-23(3,4)15-25(20)19-8-6-5-7-9-19/h5-13,16,20H,14-15H2,1-4H3,(H,24,26)
InChIKeyRUVDUDDKTIEACQ-UHFFFAOYSA-N
XLogP4.35
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.49
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(6,6-dimethyl-2-oxo-4-phenylmorpholin-3-yl)-N-(4-propan-2-ylphenyl)acetamide?
The IUPAC name of 2-(6,6-dimethyl-2-oxo-4-phenylmorpholin-3-yl)-N-(4-propan-2-ylphenyl)acetamide (CID 53244395) is 2-(6,6-dimethyl-2-oxo-4-phenylmorpholin-3-yl)-N-(4-propan-2-ylphenyl)acetamide.
What is the SMILES notation for 2-(6,6-dimethyl-2-oxo-4-phenylmorpholin-3-yl)-N-(4-propan-2-ylphenyl)acetamide?
The canonical SMILES for 2-(6,6-dimethyl-2-oxo-4-phenylmorpholin-3-yl)-N-(4-propan-2-ylphenyl)acetamide is CC(C)c1ccc(NC(=O)CC2C(=O)OC(C)(C)CN2c2ccccc2)cc1.
What is the InChIKey of 2-(6,6-dimethyl-2-oxo-4-phenylmorpholin-3-yl)-N-(4-propan-2-ylphenyl)acetamide?
The InChIKey is RUVDUDDKTIEACQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O3/c1-16(2)17-10-12-18(13-11-17)24-21(26)14-20-22(27)28-23(3,4)15-25(20)19-8-6-5-7-9-19/h5-13,16,20H,14-15H2,1-4H3,(H,24,26).
What are the key properties of 2-(6,6-dimethyl-2-oxo-4-phenylmorpholin-3-yl)-N-(4-propan-2-ylphenyl)acetamide?
2-(6,6-dimethyl-2-oxo-4-phenylmorpholin-3-yl)-N-(4-propan-2-ylphenyl)acetamide has a molecular weight of 380.49 g/mol, XLogP of 4.35, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6,6-dimethyl-2-oxo-4-phenylmorpholin-3-yl)-N-(4-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 53244395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).