N-(4-acetamidophenyl)-2-(2,6-dimethylmorpholin-4-yl)propanamide

C17H25N3O3 — CID 47005800

IUPACN-(4-acetamidophenyl)-2-(2,6-dimethylmorpholin-4-yl)propanamide
SMILESCC(=O)Nc1ccc(NC(=O)C(C)N2CC(C)OC(C)C2)cc1
InChIInChI=1S/C17H25N3O3/c1-11-9-20(10-12(2)23-11)13(3)17(22)19-16-7-5-15(6-8-16)18-14(4)21/h5-8,11-13H,9-10H2,1-4H3,(H,18,21)(H,19,22)
InChIKeyJFYPEQCJTDOXOV-UHFFFAOYSA-N
MW319.41 g/mol
LogP2.08
Rot. Bonds4

About N-(4-acetamidophenyl)-2-(2,6-dimethylmorpholin-4-yl)propanamide

N-(4-acetamidophenyl)-2-(2,6-dimethylmorpholin-4-yl)propanamide (PubChem CID 47005800) has the molecular formula C17H25N3O3 and a molecular weight of 319.41 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-(2,6-dimethylmorpholin-4-yl)propanamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2-(2,6-dimethylmorpholin-4-yl)propanamide
PubChem CID47005800
Molecular FormulaC17H25N3O3
Molecular Weight319.41 g/mol
Exact Mass319.19
IUPAC NameN-(4-acetamidophenyl)-2-(2,6-dimethylmorpholin-4-yl)propanamide
SMILESCC(=O)Nc1ccc(NC(=O)C(C)N2CC(C)OC(C)C2)cc1
InChIInChI=1S/C17H25N3O3/c1-11-9-20(10-12(2)23-11)13(3)17(22)19-16-7-5-15(6-8-16)18-14(4)21/h5-8,11-13H,9-10H2,1-4H3,(H,18,21)(H,19,22)
InChIKeyJFYPEQCJTDOXOV-UHFFFAOYSA-N
XLogP2.08
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.41
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-N-(4-cyanophenyl)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propanamide
CID 2653628
(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-(4-nitrophenyl)propanamide
CID 25401165
(2S)-N-(3-acetylphenyl)-2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]propanamide
CID 8900075
(2R)-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N-(3-fluoro-4-methylphenyl)propanamide
CID 9249085
N-(3-amino-4-fluorophenyl)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propanamide
CID 104957908
(2R)-N-(3-chlorophenyl)-2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]propanamide
CID 98938107
2-(2,6-dimethylmorpholin-4-yl)-N-(3-iodophenyl)propanamide
CID 47145118
N-(3-chloro-4-cyanophenyl)-2-(2,6-dimethylmorpholin-4-yl)propanamide
CID 46631115
(2R)-N-(3-cyanophenyl)-2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]propanamide
CID 99850769
(2R)-N-(4-chlorophenyl)-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]propanamide
CID 98319058
N-(4-tert-butylphenyl)-2-[4-(2,6-dimethylmorpholine-4-carbonyl)piperidin-1-yl]propanamide
CID 55832940
N-(4-amino-2-methylphenyl)-2-(2,6-dimethylmorpholin-4-yl)propanamide
CID 16778867

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-(2,6-dimethylmorpholin-4-yl)propanamide?
The IUPAC name of N-(4-acetamidophenyl)-2-(2,6-dimethylmorpholin-4-yl)propanamide (CID 47005800) is N-(4-acetamidophenyl)-2-(2,6-dimethylmorpholin-4-yl)propanamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2-(2,6-dimethylmorpholin-4-yl)propanamide?
The canonical SMILES for N-(4-acetamidophenyl)-2-(2,6-dimethylmorpholin-4-yl)propanamide is CC(=O)Nc1ccc(NC(=O)C(C)N2CC(C)OC(C)C2)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-2-(2,6-dimethylmorpholin-4-yl)propanamide?
The InChIKey is JFYPEQCJTDOXOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O3/c1-11-9-20(10-12(2)23-11)13(3)17(22)19-16-7-5-15(6-8-16)18-14(4)21/h5-8,11-13H,9-10H2,1-4H3,(H,18,21)(H,19,22).
What are the key properties of N-(4-acetamidophenyl)-2-(2,6-dimethylmorpholin-4-yl)propanamide?
N-(4-acetamidophenyl)-2-(2,6-dimethylmorpholin-4-yl)propanamide has a molecular weight of 319.41 g/mol, XLogP of 2.08, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2-(2,6-dimethylmorpholin-4-yl)propanamide is sourced from PubChem (CID 47005800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).