N-(2-amino-2-phenylethyl)-2-propan-2-yloxyacetamide;hydrochloride

C13H21ClN2O2 — CID 119529017

IUPACN-(2-amino-2-phenylethyl)-2-propan-2-yloxyacetamide;hydrochloride
SMILESCC(C)OCC(=O)NCC(N)c1ccccc1.Cl
InChIInChI=1S/C13H20N2O2.ClH/c1-10(2)17-9-13(16)15-8-12(14)11-6-4-3-5-7-11;/h3-7,10,12H,8-9,14H2,1-2H3,(H,15,16);1H
InChIKeyXQVQSOFINMAVLS-UHFFFAOYSA-N
MW272.78 g/mol
LogP1.65
Rot. Bonds6

About N-(2-amino-2-phenylethyl)-2-propan-2-yloxyacetamide;hydrochloride

N-(2-amino-2-phenylethyl)-2-propan-2-yloxyacetamide;hydrochloride (PubChem CID 119529017) has the molecular formula C13H21ClN2O2 and a molecular weight of 272.78 g/mol. Its IUPAC name is N-(2-amino-2-phenylethyl)-2-propan-2-yloxyacetamide;hydrochloride.

Molecular Properties

Compound NameN-(2-amino-2-phenylethyl)-2-propan-2-yloxyacetamide;hydrochloride
PubChem CID119529017
Molecular FormulaC13H21ClN2O2
Molecular Weight272.78 g/mol
Exact Mass272.13
IUPAC NameN-(2-amino-2-phenylethyl)-2-propan-2-yloxyacetamide;hydrochloride
SMILESCC(C)OCC(=O)NCC(N)c1ccccc1.Cl
InChIInChI=1S/C13H20N2O2.ClH/c1-10(2)17-9-13(16)15-8-12(14)11-6-4-3-5-7-11;/h3-7,10,12H,8-9,14H2,1-2H3,(H,15,16);1H
InChIKeyXQVQSOFINMAVLS-UHFFFAOYSA-N
XLogP1.65
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.78
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 119528845
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CID 119527625
N-(2-amino-2-phenylethyl)-2-(4-ethoxyphenoxy)acetamide;hydrochloride
CID 119528609
N-[(2S)-2-amino-2-phenylethyl]propanamide
CID 95015221
N-(2-amino-2-phenylethyl)-3,4-dimethylpentanamide;hydrochloride
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N-(2-amino-2-phenylethyl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide
CID 119527626
N-(2-amino-2-phenylethyl)-2-(2,6-dimethylphenoxy)acetamide
CID 119529545
N-(2-amino-2-phenylethyl)-2-(cyclopropylmethoxy)acetamide;hydrochloride
CID 119529587
N-(2-aminopropyl)-2-propan-2-yloxyacetamide
CID 112603386
(2-amino-2-phenylethyl)carbamic acid
CID 66941802
N-(2-amino-2-phenylethyl)-3,4,4-trimethylpentanamide
CID 63833481
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CID 119528731

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-phenylethyl)-2-propan-2-yloxyacetamide;hydrochloride?
The IUPAC name of N-(2-amino-2-phenylethyl)-2-propan-2-yloxyacetamide;hydrochloride (CID 119529017) is N-(2-amino-2-phenylethyl)-2-propan-2-yloxyacetamide;hydrochloride.
What is the SMILES notation for N-(2-amino-2-phenylethyl)-2-propan-2-yloxyacetamide;hydrochloride?
The canonical SMILES for N-(2-amino-2-phenylethyl)-2-propan-2-yloxyacetamide;hydrochloride is CC(C)OCC(=O)NCC(N)c1ccccc1.Cl.
What is the InChIKey of N-(2-amino-2-phenylethyl)-2-propan-2-yloxyacetamide;hydrochloride?
The InChIKey is XQVQSOFINMAVLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2.ClH/c1-10(2)17-9-13(16)15-8-12(14)11-6-4-3-5-7-11;/h3-7,10,12H,8-9,14H2,1-2H3,(H,15,16);1H.
What are the key properties of N-(2-amino-2-phenylethyl)-2-propan-2-yloxyacetamide;hydrochloride?
N-(2-amino-2-phenylethyl)-2-propan-2-yloxyacetamide;hydrochloride has a molecular weight of 272.78 g/mol, XLogP of 1.65, 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-propan-2-yloxyacetamide;hydrochloride is sourced from PubChem (CID 119529017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).