2-(1-ethoxypropan-2-yloxy)ethanimidamide

C7H16N2O2 — CID 103488671

IUPAC2-(1-ethoxypropan-2-yloxy)ethanimidamide
SMILES[H]/N=C(\N)COC(C)COCC
InChIInChI=1S/C7H16N2O2/c1-3-10-4-6(2)11-5-7(8)9/h6H,3-5H2,1-2H3,(H3,8,9)
InChIKeyXWBMATDGLHYTRL-UHFFFAOYSA-N
MW160.22 g/mol
LogP0.36
Rot. Bonds6

About 2-(1-ethoxypropan-2-yloxy)ethanimidamide

2-(1-ethoxypropan-2-yloxy)ethanimidamide (PubChem CID 103488671) has the molecular formula C7H16N2O2 and a molecular weight of 160.22 g/mol. Its IUPAC name is 2-(1-ethoxypropan-2-yloxy)ethanimidamide.

Molecular Properties

Compound Name2-(1-ethoxypropan-2-yloxy)ethanimidamide
PubChem CID103488671
Molecular FormulaC7H16N2O2
Molecular Weight160.22 g/mol
Exact Mass160.12
IUPAC Name2-(1-ethoxypropan-2-yloxy)ethanimidamide
SMILES[H]/N=C(\N)COC(C)COCC
InChIInChI=1S/C7H16N2O2/c1-3-10-4-6(2)11-5-7(8)9/h6H,3-5H2,1-2H3,(H3,8,9)
InChIKeyXWBMATDGLHYTRL-UHFFFAOYSA-N
XLogP0.36
TPSA68.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

2-butan-2-yloxyethanimidamide
CID 60902733
2-(2-ethoxyethoxy)ethanimidamide
CID 24707447
(2R)-1,2-diethoxypropane
CID 92973991
2-(1-ethoxypropan-2-yloxymethyl)-N-methylprop-2-en-1-amine
CID 103489370
N-(2-aminoethyl)-2-(1-ethoxypropan-2-yloxy)acetamide
CID 103487058
3-(2-ethoxyethoxy)pentanimidamide
CID 43368509
2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethanimidamide
CID 102722346
2-ethoxy-1-(2-ethoxypropoxy)propane
CID 21277912
4-propoxypentanimidamide
CID 158121909
3-methyl-4-propoxybutanimidamide
CID 158121908
ethyl 3-(1-ethoxypropan-2-yloxy)-2-(methylamino)propanoate
CID 103489818
2-(2-chloroethoxy)-1-ethoxypropane
CID 103487889

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethoxypropan-2-yloxy)ethanimidamide?
The IUPAC name of 2-(1-ethoxypropan-2-yloxy)ethanimidamide (CID 103488671) is 2-(1-ethoxypropan-2-yloxy)ethanimidamide.
What is the SMILES notation for 2-(1-ethoxypropan-2-yloxy)ethanimidamide?
The canonical SMILES for 2-(1-ethoxypropan-2-yloxy)ethanimidamide is [H]/N=C(\N)COC(C)COCC.
What is the InChIKey of 2-(1-ethoxypropan-2-yloxy)ethanimidamide?
The InChIKey is XWBMATDGLHYTRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O2/c1-3-10-4-6(2)11-5-7(8)9/h6H,3-5H2,1-2H3,(H3,8,9).
What are the key properties of 2-(1-ethoxypropan-2-yloxy)ethanimidamide?
2-(1-ethoxypropan-2-yloxy)ethanimidamide has a molecular weight of 160.22 g/mol, XLogP of 0.36, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethoxypropan-2-yloxy)ethanimidamide is sourced from PubChem (CID 103488671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).