N-(2-amino-2-oxoethoxy)-2-ethylbutanamide

C8H16N2O3 — CID 112550828

IUPACN-(2-amino-2-oxoethoxy)-2-ethylbutanamide
SMILESCCC(CC)C(=O)NOCC(N)=O
InChIInChI=1S/C8H16N2O3/c1-3-6(4-2)8(12)10-13-5-7(9)11/h6H,3-5H2,1-2H3,(H2,9,11)(H,10,12)
InChIKeyQSWDTKAKXBGIHK-UHFFFAOYSA-N
MW188.23 g/mol
LogP-0.04
Rot. Bonds6

About N-(2-amino-2-oxoethoxy)-2-ethylbutanamide

N-(2-amino-2-oxoethoxy)-2-ethylbutanamide (PubChem CID 112550828) has the molecular formula C8H16N2O3 and a molecular weight of 188.23 g/mol. Its IUPAC name is N-(2-amino-2-oxoethoxy)-2-ethylbutanamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethoxy)-2-ethylbutanamide
PubChem CID112550828
Molecular FormulaC8H16N2O3
Molecular Weight188.23 g/mol
Exact Mass188.12
IUPAC NameN-(2-amino-2-oxoethoxy)-2-ethylbutanamide
SMILESCCC(CC)C(=O)NOCC(N)=O
InChIInChI=1S/C8H16N2O3/c1-3-6(4-2)8(12)10-13-5-7(9)11/h6H,3-5H2,1-2H3,(H2,9,11)(H,10,12)
InChIKeyQSWDTKAKXBGIHK-UHFFFAOYSA-N
XLogP-0.04
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 5-0.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-ethyl-N-(2,2,2-trifluoroethoxy)butanamide
CID 81340409
2-(2-ethylbutylamino)oxyacetamide
CID 112673147
N-(2-amino-2-oxoethoxy)butanamide
CID 112550491
2-[(2-ethoxyacetyl)amino]oxyacetamide
CID 112550612
N-(2-amino-2-oxoethoxy)pentanamide
CID 112550822
3-(2-ethylbutanoylamino)oxy-3-oxopropanoic acid
CID 53423618
2-(propylaminooxy)acetamide
CID 112673221
2-(1-cyclopropylpropylamino)oxyacetamide
CID 112672608
methyl 3-[(2-amino-2-oxoethoxy)amino]-2-methylpropanoate
CID 112673719
N-(2-amino-2-oxoethoxy)-3-(ethylamino)propanamide
CID 112674083
butyl N-(2-amino-2-oxoethoxy)carbamate
CID 54092623
2-[(2-amino-2-oxoethoxy)amino]-N-methylpropanamide
CID 112673732

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethoxy)-2-ethylbutanamide?
The IUPAC name of N-(2-amino-2-oxoethoxy)-2-ethylbutanamide (CID 112550828) is N-(2-amino-2-oxoethoxy)-2-ethylbutanamide.
What is the SMILES notation for N-(2-amino-2-oxoethoxy)-2-ethylbutanamide?
The canonical SMILES for N-(2-amino-2-oxoethoxy)-2-ethylbutanamide is CCC(CC)C(=O)NOCC(N)=O.
What is the InChIKey of N-(2-amino-2-oxoethoxy)-2-ethylbutanamide?
The InChIKey is QSWDTKAKXBGIHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O3/c1-3-6(4-2)8(12)10-13-5-7(9)11/h6H,3-5H2,1-2H3,(H2,9,11)(H,10,12).
What are the key properties of N-(2-amino-2-oxoethoxy)-2-ethylbutanamide?
N-(2-amino-2-oxoethoxy)-2-ethylbutanamide has a molecular weight of 188.23 g/mol, XLogP of -0.04, 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-oxoethoxy)-2-ethylbutanamide is sourced from PubChem (CID 112550828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).