2-ethoxy-N-[2-(methylamino)ethyl]-2-phenylacetamide;hydrochloride

C13H21ClN2O2 — CID 119500210

IUPAC2-ethoxy-N-[2-(methylamino)ethyl]-2-phenylacetamide;hydrochloride
SMILESCCOC(C(=O)NCCNC)c1ccccc1.Cl
InChIInChI=1S/C13H20N2O2.ClH/c1-3-17-12(11-7-5-4-6-8-11)13(16)15-10-9-14-2;/h4-8,12,14H,3,9-10H2,1-2H3,(H,15,16);1H
InChIKeyUGCQDWGUEMQSPR-UHFFFAOYSA-N
MW272.78 g/mol
LogP1.52
Rot. Bonds7

About 2-ethoxy-N-[2-(methylamino)ethyl]-2-phenylacetamide;hydrochloride

2-ethoxy-N-[2-(methylamino)ethyl]-2-phenylacetamide;hydrochloride (PubChem CID 119500210) has the molecular formula C13H21ClN2O2 and a molecular weight of 272.78 g/mol. Its IUPAC name is 2-ethoxy-N-[2-(methylamino)ethyl]-2-phenylacetamide;hydrochloride.

Molecular Properties

Compound Name2-ethoxy-N-[2-(methylamino)ethyl]-2-phenylacetamide;hydrochloride
PubChem CID119500210
Molecular FormulaC13H21ClN2O2
Molecular Weight272.78 g/mol
Exact Mass272.13
IUPAC Name2-ethoxy-N-[2-(methylamino)ethyl]-2-phenylacetamide;hydrochloride
SMILESCCOC(C(=O)NCCNC)c1ccccc1.Cl
InChIInChI=1S/C13H20N2O2.ClH/c1-3-17-12(11-7-5-4-6-8-11)13(16)15-10-9-14-2;/h4-8,12,14H,3,9-10H2,1-2H3,(H,15,16);1H
InChIKeyUGCQDWGUEMQSPR-UHFFFAOYSA-N
XLogP1.52
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.78
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-ethoxy-N-[2-(ethylamino)ethyl]-2-phenylacetamide
CID 119504919
N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]-2-ethoxy-2-phenylacetamide;hydrochloride
CID 119525446
N-[2-(methylamino)ethyl]-2-phenyl-2-(3-propan-2-ylphenoxy)acetamide
CID 119500862
1-[[(2-ethoxy-2-phenylacetyl)amino]methyl]cyclohexane-1-carboxylic acid
CID 120543746
5-[[(2-ethoxy-2-phenylacetyl)amino]methyl]thiophene-2-carboxylic acid
CID 122110496
N-[2-(ethylamino)ethyl]-2-methoxy-2-phenylacetamide
CID 62658579
2-ethoxy-1,2-diphenylethanone;propane
CID 174923231
[2-oxo-1-phenyl-2-(propylamino)ethyl] acetate
CID 24834441
butan-2-yl 2-ethoxy-2-phenylacetate
CID 118039785
3-methyl-N-[2-[2-(methylamino)ethylamino]-2-oxo-1-phenylethyl]butanamide;hydrochloride
CID 119500815
2-(3-bromophenoxy)-N-[3-(methylamino)propyl]-2-phenylacetamide;hydrochloride
CID 119432773
N-[2-(methylamino)ethyl]-2-phenoxypropanamide
CID 119503949

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[2-(methylamino)ethyl]-2-phenylacetamide;hydrochloride?
The IUPAC name of 2-ethoxy-N-[2-(methylamino)ethyl]-2-phenylacetamide;hydrochloride (CID 119500210) is 2-ethoxy-N-[2-(methylamino)ethyl]-2-phenylacetamide;hydrochloride.
What is the SMILES notation for 2-ethoxy-N-[2-(methylamino)ethyl]-2-phenylacetamide;hydrochloride?
The canonical SMILES for 2-ethoxy-N-[2-(methylamino)ethyl]-2-phenylacetamide;hydrochloride is CCOC(C(=O)NCCNC)c1ccccc1.Cl.
What is the InChIKey of 2-ethoxy-N-[2-(methylamino)ethyl]-2-phenylacetamide;hydrochloride?
The InChIKey is UGCQDWGUEMQSPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2.ClH/c1-3-17-12(11-7-5-4-6-8-11)13(16)15-10-9-14-2;/h4-8,12,14H,3,9-10H2,1-2H3,(H,15,16);1H.
What are the key properties of 2-ethoxy-N-[2-(methylamino)ethyl]-2-phenylacetamide;hydrochloride?
2-ethoxy-N-[2-(methylamino)ethyl]-2-phenylacetamide;hydrochloride has a molecular weight of 272.78 g/mol, XLogP of 1.52, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[2-(methylamino)ethyl]-2-phenylacetamide;hydrochloride is sourced from PubChem (CID 119500210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).