N-(4-ethylphenyl)-N-(3-morpholin-4-yl-3-oxopropyl)acetamide

C17H24N2O3 — CID 113125340

IUPACN-(4-ethylphenyl)-N-(3-morpholin-4-yl-3-oxopropyl)acetamide
SMILESCCc1ccc(N(CCC(=O)N2CCOCC2)C(C)=O)cc1
InChIInChI=1S/C17H24N2O3/c1-3-15-4-6-16(7-5-15)19(14(2)20)9-8-17(21)18-10-12-22-13-11-18/h4-7H,3,8-13H2,1-2H3
InChIKeyCQMZOEKYAQJSPV-UHFFFAOYSA-N
MW304.39 g/mol
LogP1.85
Rot. Bonds5

About N-(4-ethylphenyl)-N-(3-morpholin-4-yl-3-oxopropyl)acetamide

N-(4-ethylphenyl)-N-(3-morpholin-4-yl-3-oxopropyl)acetamide (PubChem CID 113125340) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is N-(4-ethylphenyl)-N-(3-morpholin-4-yl-3-oxopropyl)acetamide.

Molecular Properties

Compound NameN-(4-ethylphenyl)-N-(3-morpholin-4-yl-3-oxopropyl)acetamide
PubChem CID113125340
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC NameN-(4-ethylphenyl)-N-(3-morpholin-4-yl-3-oxopropyl)acetamide
SMILESCCc1ccc(N(CCC(=O)N2CCOCC2)C(C)=O)cc1
InChIInChI=1S/C17H24N2O3/c1-3-15-4-6-16(7-5-15)19(14(2)20)9-8-17(21)18-10-12-22-13-11-18/h4-7H,3,8-13H2,1-2H3
InChIKeyCQMZOEKYAQJSPV-UHFFFAOYSA-N
XLogP1.85
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 4-[3-(N-acetyl-4-ethylanilino)propanoyl]piperazine-1-carboxylate
CID 113125387
N-(4-ethylphenyl)-N-[3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxopropyl]acetamide
CID 113125379
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(3-morpholin-4-yl-3-oxopropyl)acetamide
CID 113132985
N-(1,3-benzodioxol-5-yl)-N-(3-morpholin-4-yl-3-oxopropyl)acetamide
CID 113132829
N-[4-(4-methylpiperidin-1-yl)phenyl]-N-(3-morpholin-4-yl-3-oxopropyl)acetamide
CID 113132119
N-(3,5-dichlorophenyl)-N-(3-morpholin-4-yl-3-oxopropyl)acetamide
CID 113134062
N-(3-chloro-4-fluorophenyl)-N-(3-morpholin-4-yl-3-oxopropyl)acetamide
CID 113128120
N-(3-chlorophenyl)-N-(3-morpholin-4-yl-3-oxopropyl)acetamide
CID 113127190
N-[3-(4-acetylpiperazin-1-yl)-3-oxopropyl]-N-(4-methylphenyl)acetamide
CID 113123942
N-[3-(4-acetylpiperazin-1-yl)-3-oxopropyl]-N-phenylacetamide
CID 113123354
N-(3-oxo-3-pyrrolidin-1-ylpropyl)-N-phenylacetamide
CID 113123338
N-(2-ethoxyphenyl)-N-(3-morpholin-4-yl-3-oxopropyl)acetamide
CID 113129229

Frequently Asked Questions

What is the IUPAC name of N-(4-ethylphenyl)-N-(3-morpholin-4-yl-3-oxopropyl)acetamide?
The IUPAC name of N-(4-ethylphenyl)-N-(3-morpholin-4-yl-3-oxopropyl)acetamide (CID 113125340) is N-(4-ethylphenyl)-N-(3-morpholin-4-yl-3-oxopropyl)acetamide.
What is the SMILES notation for N-(4-ethylphenyl)-N-(3-morpholin-4-yl-3-oxopropyl)acetamide?
The canonical SMILES for N-(4-ethylphenyl)-N-(3-morpholin-4-yl-3-oxopropyl)acetamide is CCc1ccc(N(CCC(=O)N2CCOCC2)C(C)=O)cc1.
What is the InChIKey of N-(4-ethylphenyl)-N-(3-morpholin-4-yl-3-oxopropyl)acetamide?
The InChIKey is CQMZOEKYAQJSPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c1-3-15-4-6-16(7-5-15)19(14(2)20)9-8-17(21)18-10-12-22-13-11-18/h4-7H,3,8-13H2,1-2H3.
What are the key properties of N-(4-ethylphenyl)-N-(3-morpholin-4-yl-3-oxopropyl)acetamide?
N-(4-ethylphenyl)-N-(3-morpholin-4-yl-3-oxopropyl)acetamide has a molecular weight of 304.39 g/mol, XLogP of 1.85, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)-N-(3-morpholin-4-yl-3-oxopropyl)acetamide is sourced from PubChem (CID 113125340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).