2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)-N-pyridin-3-ylacetamide

C15H21N3O3 — CID 53244783

IUPAC2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)-N-pyridin-3-ylacetamide
SMILESCCN1CC(C)(C)OC(=O)C1CC(=O)Nc1cccnc1
InChIInChI=1S/C15H21N3O3/c1-4-18-10-15(2,3)21-14(20)12(18)8-13(19)17-11-6-5-7-16-9-11/h5-7,9,12H,4,8,10H2,1-3H3,(H,17,19)
InChIKeyWPZHUXNDEWIHSG-UHFFFAOYSA-N
MW291.35 g/mol
LogP1.44
Rot. Bonds4

About 2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)-N-pyridin-3-ylacetamide

2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)-N-pyridin-3-ylacetamide (PubChem CID 53244783) has the molecular formula C15H21N3O3 and a molecular weight of 291.35 g/mol. Its IUPAC name is 2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)-N-pyridin-3-ylacetamide.

Molecular Properties

Compound Name2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)-N-pyridin-3-ylacetamide
PubChem CID53244783
Molecular FormulaC15H21N3O3
Molecular Weight291.35 g/mol
Exact Mass291.16
IUPAC Name2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)-N-pyridin-3-ylacetamide
SMILESCCN1CC(C)(C)OC(=O)C1CC(=O)Nc1cccnc1
InChIInChI=1S/C15H21N3O3/c1-4-18-10-15(2,3)21-14(20)12(18)8-13(19)17-11-6-5-7-16-9-11/h5-7,9,12H,4,8,10H2,1-3H3,(H,17,19)
InChIKeyWPZHUXNDEWIHSG-UHFFFAOYSA-N
XLogP1.44
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)-N-pyridin-3-ylacetamide?
The IUPAC name of 2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)-N-pyridin-3-ylacetamide (CID 53244783) is 2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)-N-pyridin-3-ylacetamide.
What is the SMILES notation for 2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)-N-pyridin-3-ylacetamide?
The canonical SMILES for 2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)-N-pyridin-3-ylacetamide is CCN1CC(C)(C)OC(=O)C1CC(=O)Nc1cccnc1.
What is the InChIKey of 2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)-N-pyridin-3-ylacetamide?
The InChIKey is WPZHUXNDEWIHSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3/c1-4-18-10-15(2,3)21-14(20)12(18)8-13(19)17-11-6-5-7-16-9-11/h5-7,9,12H,4,8,10H2,1-3H3,(H,17,19).
What are the key properties of 2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)-N-pyridin-3-ylacetamide?
2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)-N-pyridin-3-ylacetamide has a molecular weight of 291.35 g/mol, XLogP of 1.44, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)-N-pyridin-3-ylacetamide is sourced from PubChem (CID 53244783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).