N-(2-amino-2-phenylethyl)-2-ethoxyacetamide;hydrochloride

C12H19ClN2O2 — CID 119528845

IUPACN-(2-amino-2-phenylethyl)-2-ethoxyacetamide;hydrochloride
SMILESCCOCC(=O)NCC(N)c1ccccc1.Cl
InChIInChI=1S/C12H18N2O2.ClH/c1-2-16-9-12(15)14-8-11(13)10-6-4-3-5-7-10;/h3-7,11H,2,8-9,13H2,1H3,(H,14,15);1H
InChIKeyYANPOWFVDUTMFX-UHFFFAOYSA-N
MW258.75 g/mol
LogP1.26
Rot. Bonds6

About N-(2-amino-2-phenylethyl)-2-ethoxyacetamide;hydrochloride

N-(2-amino-2-phenylethyl)-2-ethoxyacetamide;hydrochloride (PubChem CID 119528845) has the molecular formula C12H19ClN2O2 and a molecular weight of 258.75 g/mol. Its IUPAC name is N-(2-amino-2-phenylethyl)-2-ethoxyacetamide;hydrochloride.

Molecular Properties

Compound NameN-(2-amino-2-phenylethyl)-2-ethoxyacetamide;hydrochloride
PubChem CID119528845
Molecular FormulaC12H19ClN2O2
Molecular Weight258.75 g/mol
Exact Mass258.11
IUPAC NameN-(2-amino-2-phenylethyl)-2-ethoxyacetamide;hydrochloride
SMILESCCOCC(=O)NCC(N)c1ccccc1.Cl
InChIInChI=1S/C12H18N2O2.ClH/c1-2-16-9-12(15)14-8-11(13)10-6-4-3-5-7-10;/h3-7,11H,2,8-9,13H2,1H3,(H,14,15);1H
InChIKeyYANPOWFVDUTMFX-UHFFFAOYSA-N
XLogP1.26
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.75
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 119529017
2-ethoxy-N-(2-phenylpropyl)acetamide
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N-(2-amino-2-phenylethyl)-2-(cyclopropylmethoxy)acetamide;hydrochloride
CID 119529587
N-[(2S)-2-amino-2-phenylethyl]propanamide
CID 95015221
N-(2-amino-2-phenylethyl)-2-(2,6-dimethylphenoxy)acetamide
CID 119529545
N-(2-amino-2-phenylethyl)pentanamide
CID 63120587
N-(2-amino-2-phenylethyl)-2-propylsulfonylacetamide;hydrochloride
CID 119527676
N-(2-amino-2-phenylethyl)hexanamide
CID 55225513
N-(2-amino-2-phenylethyl)-3,4-dimethylpentanamide;hydrochloride
CID 119529641
N-(2-amino-1-phenylethyl)-2-ethoxyacetamide
CID 63755765
N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]-2-propoxyacetamide
CID 119526031

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-phenylethyl)-2-ethoxyacetamide;hydrochloride?
The IUPAC name of N-(2-amino-2-phenylethyl)-2-ethoxyacetamide;hydrochloride (CID 119528845) is N-(2-amino-2-phenylethyl)-2-ethoxyacetamide;hydrochloride.
What is the SMILES notation for N-(2-amino-2-phenylethyl)-2-ethoxyacetamide;hydrochloride?
The canonical SMILES for N-(2-amino-2-phenylethyl)-2-ethoxyacetamide;hydrochloride is CCOCC(=O)NCC(N)c1ccccc1.Cl.
What is the InChIKey of N-(2-amino-2-phenylethyl)-2-ethoxyacetamide;hydrochloride?
The InChIKey is YANPOWFVDUTMFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2.ClH/c1-2-16-9-12(15)14-8-11(13)10-6-4-3-5-7-10;/h3-7,11H,2,8-9,13H2,1H3,(H,14,15);1H.
What are the key properties of N-(2-amino-2-phenylethyl)-2-ethoxyacetamide;hydrochloride?
N-(2-amino-2-phenylethyl)-2-ethoxyacetamide;hydrochloride has a molecular weight of 258.75 g/mol, XLogP of 1.26, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-phenylethyl)-2-ethoxyacetamide;hydrochloride is sourced from PubChem (CID 119528845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).