N-(2-amino-1-phenylethyl)-2-ethoxyacetamide

C12H18N2O2 — CID 63755765

IUPACN-(2-amino-1-phenylethyl)-2-ethoxyacetamide
SMILESCCOCC(=O)NC(CN)c1ccccc1
InChIInChI=1S/C12H18N2O2/c1-2-16-9-12(15)14-11(8-13)10-6-4-3-5-7-10/h3-7,11H,2,8-9,13H2,1H3,(H,14,15)
InChIKeyYIPFWHMCXKLWDE-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.84
Rot. Bonds6

About N-(2-amino-1-phenylethyl)-2-ethoxyacetamide

N-(2-amino-1-phenylethyl)-2-ethoxyacetamide (PubChem CID 63755765) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is N-(2-amino-1-phenylethyl)-2-ethoxyacetamide.

Molecular Properties

Compound NameN-(2-amino-1-phenylethyl)-2-ethoxyacetamide
PubChem CID63755765
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC NameN-(2-amino-1-phenylethyl)-2-ethoxyacetamide
SMILESCCOCC(=O)NC(CN)c1ccccc1
InChIInChI=1S/C12H18N2O2/c1-2-16-9-12(15)14-11(8-13)10-6-4-3-5-7-10/h3-7,11H,2,8-9,13H2,1H3,(H,14,15)
InChIKeyYIPFWHMCXKLWDE-UHFFFAOYSA-N
XLogP0.84
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethoxy-N-(2-hydroxy-1-phenylethyl)acetamide
CID 63184517
2-ethoxy-N-[(1S)-2-hydroxy-1-phenylethyl]acetamide
CID 103944946
4-[(2-ethoxyacetyl)amino]-4-phenylbutanoic acid
CID 60825345
N-(2-amino-1-phenyl-2-sulfanylideneethyl)-2-ethoxyacetamide
CID 61119625
(2-amino-1-phenylethyl)carbamic acid
CID 66600321
N-(2-amino-2-phenylethyl)-2-ethoxyacetamide;hydrochloride
CID 119528845
2-(2-methoxyethoxy)-N-(1-phenylpropyl)acetamide
CID 103612351
2-[2-[(3,3-dimethyl-1-phenylbutyl)amino]-2-oxoethoxy]acetic acid
CID 61329225
3-[[2-(2-methoxyethoxy)acetyl]amino]-3-phenylpropanoic acid
CID 43358425
2-ethoxy-N-[1-(4-methoxyphenyl)propyl]acetamide
CID 60657142
2-ethoxy-N-[furan-2-yl(phenyl)methyl]acetamide
CID 60712310
2-ethoxy-N-[phenyl(thiophen-2-yl)methyl]acetamide
CID 60682552

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-phenylethyl)-2-ethoxyacetamide?
The IUPAC name of N-(2-amino-1-phenylethyl)-2-ethoxyacetamide (CID 63755765) is N-(2-amino-1-phenylethyl)-2-ethoxyacetamide.
What is the SMILES notation for N-(2-amino-1-phenylethyl)-2-ethoxyacetamide?
The canonical SMILES for N-(2-amino-1-phenylethyl)-2-ethoxyacetamide is CCOCC(=O)NC(CN)c1ccccc1.
What is the InChIKey of N-(2-amino-1-phenylethyl)-2-ethoxyacetamide?
The InChIKey is YIPFWHMCXKLWDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-2-16-9-12(15)14-11(8-13)10-6-4-3-5-7-10/h3-7,11H,2,8-9,13H2,1H3,(H,14,15).
What are the key properties of N-(2-amino-1-phenylethyl)-2-ethoxyacetamide?
N-(2-amino-1-phenylethyl)-2-ethoxyacetamide has a molecular weight of 222.29 g/mol, XLogP of 0.84, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-phenylethyl)-2-ethoxyacetamide is sourced from PubChem (CID 63755765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).