N-(3-acetylphenyl)-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide

C17H23N3O4 — CID 8711319

IUPACN-(3-acetylphenyl)-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide
SMILESCC(=O)c1cccc(NC(=O)CN(C)CC(=O)N2CCOCC2)c1
InChIInChI=1S/C17H23N3O4/c1-13(21)14-4-3-5-15(10-14)18-16(22)11-19(2)12-17(23)20-6-8-24-9-7-20/h3-5,10H,6-9,11-12H2,1-2H3,(H,18,22)
InChIKeyAVNACKOIBHUKEA-UHFFFAOYSA-N
MW333.39 g/mol
LogP0.62
Rot. Bonds6

About N-(3-acetylphenyl)-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide

N-(3-acetylphenyl)-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide (PubChem CID 8711319) has the molecular formula C17H23N3O4 and a molecular weight of 333.39 g/mol. Its IUPAC name is N-(3-acetylphenyl)-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide
PubChem CID8711319
Molecular FormulaC17H23N3O4
Molecular Weight333.39 g/mol
Exact Mass333.17
IUPAC NameN-(3-acetylphenyl)-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide
SMILESCC(=O)c1cccc(NC(=O)CN(C)CC(=O)N2CCOCC2)c1
InChIInChI=1S/C17H23N3O4/c1-13(21)14-4-3-5-15(10-14)18-16(22)11-19(2)12-17(23)20-6-8-24-9-7-20/h3-5,10H,6-9,11-12H2,1-2H3,(H,18,22)
InChIKeyAVNACKOIBHUKEA-UHFFFAOYSA-N
XLogP0.62
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide?
The IUPAC name of N-(3-acetylphenyl)-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide (CID 8711319) is N-(3-acetylphenyl)-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide.
What is the SMILES notation for N-(3-acetylphenyl)-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide?
The canonical SMILES for N-(3-acetylphenyl)-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide is CC(=O)c1cccc(NC(=O)CN(C)CC(=O)N2CCOCC2)c1.
What is the InChIKey of N-(3-acetylphenyl)-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide?
The InChIKey is AVNACKOIBHUKEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O4/c1-13(21)14-4-3-5-15(10-14)18-16(22)11-19(2)12-17(23)20-6-8-24-9-7-20/h3-5,10H,6-9,11-12H2,1-2H3,(H,18,22).
What are the key properties of N-(3-acetylphenyl)-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide?
N-(3-acetylphenyl)-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide has a molecular weight of 333.39 g/mol, XLogP of 0.62, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide is sourced from PubChem (CID 8711319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).