N-(2-amino-2-ethylbutyl)-2-propoxyacetamide;hydrochloride

C11H25ClN2O2 — CID 119641121

IUPACN-(2-amino-2-ethylbutyl)-2-propoxyacetamide;hydrochloride
SMILESCCCOCC(=O)NCC(N)(CC)CC.Cl
InChIInChI=1S/C11H24N2O2.ClH/c1-4-7-15-8-10(14)13-9-11(12,5-2)6-3;/h4-9,12H2,1-3H3,(H,13,14);1H
InChIKeyUSGFMWZWBBWQSG-UHFFFAOYSA-N
MW252.79 g/mol
LogP1.47
Rot. Bonds8

About N-(2-amino-2-ethylbutyl)-2-propoxyacetamide;hydrochloride

N-(2-amino-2-ethylbutyl)-2-propoxyacetamide;hydrochloride (PubChem CID 119641121) has the molecular formula C11H25ClN2O2 and a molecular weight of 252.79 g/mol. Its IUPAC name is N-(2-amino-2-ethylbutyl)-2-propoxyacetamide;hydrochloride.

Molecular Properties

Compound NameN-(2-amino-2-ethylbutyl)-2-propoxyacetamide;hydrochloride
PubChem CID119641121
Molecular FormulaC11H25ClN2O2
Molecular Weight252.79 g/mol
Exact Mass252.16
IUPAC NameN-(2-amino-2-ethylbutyl)-2-propoxyacetamide;hydrochloride
SMILESCCCOCC(=O)NCC(N)(CC)CC.Cl
InChIInChI=1S/C11H24N2O2.ClH/c1-4-7-15-8-10(14)13-9-11(12,5-2)6-3;/h4-9,12H2,1-3H3,(H,13,14);1H
InChIKeyUSGFMWZWBBWQSG-UHFFFAOYSA-N
XLogP1.47
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.79
LogP ≤ 51.47
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

N-(2-amino-2-ethylbutyl)-2-pentoxyacetamide;hydrochloride
CID 119639970
N-(2-amino-2-ethylbutyl)-2-butoxyacetamide
CID 119640904
N-(2-amino-2-ethylbutyl)-2-ethoxyacetamide;hydrochloride
CID 119642392
N-(2-amino-2-ethylbutyl)-2-(2-phenylethoxy)acetamide
CID 119643311
N-[2-ethyl-2-(hydroxymethyl)butyl]-2-propoxyacetamide
CID 103843568
N-(3-amino-2,2-dimethyl-3-sulfanylidenepropyl)-2-propoxyacetamide
CID 107939067
N-(2,2-difluoro-3-hydroxypropyl)-2-propoxyacetamide
CID 104858090
N-(2-hydroxy-2-methylpentyl)-2-propoxyacetamide
CID 103713311
N'-(2-amino-2-ethylbutyl)-N-ethylpentanediamide;hydrochloride
CID 119643328
N-(2-amino-2-methylpropyl)-2-(2-ethoxyethoxy)acetamide
CID 119626722
N-(2-amino-2-ethylbutyl)-2-(diethylamino)acetamide;dihydrochloride
CID 119640041
N'-(2-amino-2-ethylbutyl)-N-propylbutanediamide;hydrochloride
CID 119642895

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-ethylbutyl)-2-propoxyacetamide;hydrochloride?
The IUPAC name of N-(2-amino-2-ethylbutyl)-2-propoxyacetamide;hydrochloride (CID 119641121) is N-(2-amino-2-ethylbutyl)-2-propoxyacetamide;hydrochloride.
What is the SMILES notation for N-(2-amino-2-ethylbutyl)-2-propoxyacetamide;hydrochloride?
The canonical SMILES for N-(2-amino-2-ethylbutyl)-2-propoxyacetamide;hydrochloride is CCCOCC(=O)NCC(N)(CC)CC.Cl.
What is the InChIKey of N-(2-amino-2-ethylbutyl)-2-propoxyacetamide;hydrochloride?
The InChIKey is USGFMWZWBBWQSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2.ClH/c1-4-7-15-8-10(14)13-9-11(12,5-2)6-3;/h4-9,12H2,1-3H3,(H,13,14);1H.
What are the key properties of N-(2-amino-2-ethylbutyl)-2-propoxyacetamide;hydrochloride?
N-(2-amino-2-ethylbutyl)-2-propoxyacetamide;hydrochloride has a molecular weight of 252.79 g/mol, XLogP of 1.47, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-ethylbutyl)-2-propoxyacetamide;hydrochloride is sourced from PubChem (CID 119641121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).