4-methyl-5-oxo-3-phenyl-N-(pyridin-4-ylmethyl)morpholine-2-carboxamide

C18H19N3O3 — CID 71687674

IUPAC4-methyl-5-oxo-3-phenyl-N-(pyridin-4-ylmethyl)morpholine-2-carboxamide
SMILESCN1C(=O)COC(C(=O)NCc2ccncc2)C1c1ccccc1
InChIInChI=1S/C18H19N3O3/c1-21-15(22)12-24-17(16(21)14-5-3-2-4-6-14)18(23)20-11-13-7-9-19-10-8-13/h2-10,16-17H,11-12H2,1H3,(H,20,23)
InChIKeyULQDRQLZURQIHO-UHFFFAOYSA-N
MW325.37 g/mol
LogP1.30
Rot. Bonds4

About 4-methyl-5-oxo-3-phenyl-N-(pyridin-4-ylmethyl)morpholine-2-carboxamide

4-methyl-5-oxo-3-phenyl-N-(pyridin-4-ylmethyl)morpholine-2-carboxamide (PubChem CID 71687674) has the molecular formula C18H19N3O3 and a molecular weight of 325.37 g/mol. Its IUPAC name is 4-methyl-5-oxo-3-phenyl-N-(pyridin-4-ylmethyl)morpholine-2-carboxamide.

Molecular Properties

Compound Name4-methyl-5-oxo-3-phenyl-N-(pyridin-4-ylmethyl)morpholine-2-carboxamide
PubChem CID71687674
Molecular FormulaC18H19N3O3
Molecular Weight325.37 g/mol
Exact Mass325.14
IUPAC Name4-methyl-5-oxo-3-phenyl-N-(pyridin-4-ylmethyl)morpholine-2-carboxamide
SMILESCN1C(=O)COC(C(=O)NCc2ccncc2)C1c1ccccc1
InChIInChI=1S/C18H19N3O3/c1-21-15(22)12-24-17(16(21)14-5-3-2-4-6-14)18(23)20-11-13-7-9-19-10-8-13/h2-10,16-17H,11-12H2,1H3,(H,20,23)
InChIKeyULQDRQLZURQIHO-UHFFFAOYSA-N
XLogP1.30
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-methyl-5-oxo-3-phenyl-N-(pyridin-4-ylmethyl)morpholine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-oxo-3-phenyl-N-(pyridin-4-ylmethyl)morpholine-2-carboxamide?
The IUPAC name of 4-methyl-5-oxo-3-phenyl-N-(pyridin-4-ylmethyl)morpholine-2-carboxamide (CID 71687674) is 4-methyl-5-oxo-3-phenyl-N-(pyridin-4-ylmethyl)morpholine-2-carboxamide.
What is the SMILES notation for 4-methyl-5-oxo-3-phenyl-N-(pyridin-4-ylmethyl)morpholine-2-carboxamide?
The canonical SMILES for 4-methyl-5-oxo-3-phenyl-N-(pyridin-4-ylmethyl)morpholine-2-carboxamide is CN1C(=O)COC(C(=O)NCc2ccncc2)C1c1ccccc1.
What is the InChIKey of 4-methyl-5-oxo-3-phenyl-N-(pyridin-4-ylmethyl)morpholine-2-carboxamide?
The InChIKey is ULQDRQLZURQIHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O3/c1-21-15(22)12-24-17(16(21)14-5-3-2-4-6-14)18(23)20-11-13-7-9-19-10-8-13/h2-10,16-17H,11-12H2,1H3,(H,20,23).
What are the key properties of 4-methyl-5-oxo-3-phenyl-N-(pyridin-4-ylmethyl)morpholine-2-carboxamide?
4-methyl-5-oxo-3-phenyl-N-(pyridin-4-ylmethyl)morpholine-2-carboxamide has a molecular weight of 325.37 g/mol, XLogP of 1.30, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-oxo-3-phenyl-N-(pyridin-4-ylmethyl)morpholine-2-carboxamide is sourced from PubChem (CID 71687674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).