3-acetamido-N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)-N-methylpropanamide

C17H27N3O3 — CID 119582642

IUPAC3-acetamido-N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)-N-methylpropanamide
SMILESCCOc1ccccc1C(CC(=O)N(C)C(C)CN)NC(C)=O
InChIInChI=1S/C17H27N3O3/c1-5-23-16-9-7-6-8-14(16)15(19-13(3)21)10-17(22)20(4)12(2)11-18/h6-9,12,15H,5,10-11,18H2,1-4H3,(H,19,21)
InChIKeyOLWJTUDCMAGFNP-UHFFFAOYSA-N
MW321.42 g/mol
LogP1.46
Rot. Bonds8

About 3-acetamido-N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)-N-methylpropanamide

3-acetamido-N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)-N-methylpropanamide (PubChem CID 119582642) has the molecular formula C17H27N3O3 and a molecular weight of 321.42 g/mol. Its IUPAC name is 3-acetamido-N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)-N-methylpropanamide.

Molecular Properties

Compound Name3-acetamido-N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)-N-methylpropanamide
PubChem CID119582642
Molecular FormulaC17H27N3O3
Molecular Weight321.42 g/mol
Exact Mass321.21
IUPAC Name3-acetamido-N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)-N-methylpropanamide
SMILESCCOc1ccccc1C(CC(=O)N(C)C(C)CN)NC(C)=O
InChIInChI=1S/C17H27N3O3/c1-5-23-16-9-7-6-8-14(16)15(19-13(3)21)10-17(22)20(4)12(2)11-18/h6-9,12,15H,5,10-11,18H2,1-4H3,(H,19,21)
InChIKeyOLWJTUDCMAGFNP-UHFFFAOYSA-N
XLogP1.46
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.42
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-acetamido-N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)-N-methylpropanamide with MolForge

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

Launch Full Analysis

Related Compounds

3-acetamido-N-(3-amino-2,2-dimethylpropyl)-3-(2-ethoxyphenyl)-N-methylpropanamide
CID 119654044
3-acetamido-N-(2-amino-2-methylpropyl)-3-(2-ethoxyphenyl)propanamide
CID 119627423
3-[[3-acetamido-3-(2-ethoxyphenyl)propanoyl]amino]-2-methylpropanoic acid
CID 119237711
3-acetamido-3-(2-ethoxyphenyl)-N-[2-(methylamino)propyl]propanamide
CID 120830987
3-acetamido-N-[1-(aminomethyl)cyclopentyl]-3-(2-ethoxyphenyl)propanamide
CID 119566114
N-(1-aminopropan-2-yl)-4-(2-ethoxyphenoxy)-N-methylbutanamide
CID 119585067
N-[(1R)-1-(2-ethoxyphenyl)-3-oxo-3-piperidin-1-ylpropyl]acetamide
CID 95282390
3-[[3-acetamido-3-(2-ethoxyphenyl)propanoyl]amino]-2,2-dimethylpropanoic acid
CID 119250389
3-acetamido-N-(8-azabicyclo[3.2.1]octan-3-yl)-3-(2-ethoxyphenyl)propanamide
CID 119456660
3-acetamido-N-(3-amino-4-methoxyphenyl)-3-(2-ethoxyphenyl)propanamide;hydrochloride
CID 119419483
4-[[3-acetamido-3-(2-ethoxyphenyl)propanoyl]amino]-4-methylpentanoic acid
CID 119204666
N-[3-[(3aS,6aR)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl]-1-(2-ethoxyphenyl)-3-oxopropyl]acetamide;hydrochloride
CID 120659450

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)-N-methylpropanamide?
The IUPAC name of 3-acetamido-N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)-N-methylpropanamide (CID 119582642) is 3-acetamido-N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)-N-methylpropanamide.
What is the SMILES notation for 3-acetamido-N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)-N-methylpropanamide?
The canonical SMILES for 3-acetamido-N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)-N-methylpropanamide is CCOc1ccccc1C(CC(=O)N(C)C(C)CN)NC(C)=O.
What is the InChIKey of 3-acetamido-N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)-N-methylpropanamide?
The InChIKey is OLWJTUDCMAGFNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O3/c1-5-23-16-9-7-6-8-14(16)15(19-13(3)21)10-17(22)20(4)12(2)11-18/h6-9,12,15H,5,10-11,18H2,1-4H3,(H,19,21).
What are the key properties of 3-acetamido-N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)-N-methylpropanamide?
3-acetamido-N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)-N-methylpropanamide has a molecular weight of 321.42 g/mol, XLogP of 1.46, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)-N-methylpropanamide is sourced from PubChem (CID 119582642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).