2-(2-aminoethoxy)-N-(2-propan-2-ylphenyl)acetamide

C13H20N2O2 — CID 79463489

IUPAC2-(2-aminoethoxy)-N-(2-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccccc1NC(=O)COCCN
InChIInChI=1S/C13H20N2O2/c1-10(2)11-5-3-4-6-12(11)15-13(16)9-17-8-7-14/h3-6,10H,7-9,14H2,1-2H3,(H,15,16)
InChIKeyLLCJEIZKDXAELM-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.72
Rot. Bonds6

About 2-(2-aminoethoxy)-N-(2-propan-2-ylphenyl)acetamide

2-(2-aminoethoxy)-N-(2-propan-2-ylphenyl)acetamide (PubChem CID 79463489) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 2-(2-aminoethoxy)-N-(2-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-aminoethoxy)-N-(2-propan-2-ylphenyl)acetamide
PubChem CID79463489
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name2-(2-aminoethoxy)-N-(2-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccccc1NC(=O)COCCN
InChIInChI=1S/C13H20N2O2/c1-10(2)11-5-3-4-6-12(11)15-13(16)9-17-8-7-14/h3-6,10H,7-9,14H2,1-2H3,(H,15,16)
InChIKeyLLCJEIZKDXAELM-UHFFFAOYSA-N
XLogP1.72
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-(2-aminoethoxy)-N-(2-propan-2-ylphenyl)acetamide 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-amino-N-(2-propan-2-ylphenyl)propanamide;hydrochloride
CID 71828995
2-(2-aminoethoxy)-N-[2-(2-methylpropoxy)phenyl]acetamide
CID 79474018
[2-oxo-2-(2-propan-2-ylanilino)ethyl] (2S)-2-phenoxypropanoate
CID 2385789
2-phenoxy-N-(2-propan-2-ylphenyl)acetamide
CID 723304
N-[2-(1-bromoethyl)phenyl]-2-(2-methoxyethoxy)acetamide
CID 114032037
[2-oxo-2-(2-propan-2-ylanilino)ethyl] (2S)-2-hydroxy-2-phenylacetate
CID 7834198
[2-oxo-2-(2-propan-2-ylanilino)ethyl] 3-methylbut-2-enoate
CID 2567186
[2-oxo-2-(2-propan-2-ylanilino)ethyl] cyclopropanecarboxylate
CID 2488778
2-(2-aminoethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide
CID 79463675
N-(2-propan-2-ylphenyl)propanamide
CID 723442
2-iodo-N-(2-propan-2-ylphenyl)acetamide
CID 4198881
4-amino-3-methyl-N-(2-propan-2-ylphenyl)butanamide
CID 81071847

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoethoxy)-N-(2-propan-2-ylphenyl)acetamide?
The IUPAC name of 2-(2-aminoethoxy)-N-(2-propan-2-ylphenyl)acetamide (CID 79463489) is 2-(2-aminoethoxy)-N-(2-propan-2-ylphenyl)acetamide.
What is the SMILES notation for 2-(2-aminoethoxy)-N-(2-propan-2-ylphenyl)acetamide?
The canonical SMILES for 2-(2-aminoethoxy)-N-(2-propan-2-ylphenyl)acetamide is CC(C)c1ccccc1NC(=O)COCCN.
What is the InChIKey of 2-(2-aminoethoxy)-N-(2-propan-2-ylphenyl)acetamide?
The InChIKey is LLCJEIZKDXAELM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-10(2)11-5-3-4-6-12(11)15-13(16)9-17-8-7-14/h3-6,10H,7-9,14H2,1-2H3,(H,15,16).
What are the key properties of 2-(2-aminoethoxy)-N-(2-propan-2-ylphenyl)acetamide?
2-(2-aminoethoxy)-N-(2-propan-2-ylphenyl)acetamide has a molecular weight of 236.31 g/mol, XLogP of 1.72, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethoxy)-N-(2-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 79463489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).