N'-ethyl-2-methoxy-2-methylpropanimidamide

C7H16N2O — CID 79197267

IUPACN'-ethyl-2-methoxy-2-methylpropanimidamide
SMILESCC/N=C(\N)C(C)(C)OC
InChIInChI=1S/C7H16N2O/c1-5-9-6(8)7(2,3)10-4/h5H2,1-4H3,(H2,8,9)
InChIKeyORKOEXDOADOBHK-UHFFFAOYSA-N
MW144.22 g/mol
LogP0.79
Rot. Bonds3

About N'-ethyl-2-methoxy-2-methylpropanimidamide

N'-ethyl-2-methoxy-2-methylpropanimidamide (PubChem CID 79197267) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is N'-ethyl-2-methoxy-2-methylpropanimidamide.

Molecular Properties

Compound NameN'-ethyl-2-methoxy-2-methylpropanimidamide
PubChem CID79197267
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC NameN'-ethyl-2-methoxy-2-methylpropanimidamide
SMILESCC/N=C(\N)C(C)(C)OC
InChIInChI=1S/C7H16N2O/c1-5-9-6(8)7(2,3)10-4/h5H2,1-4H3,(H2,8,9)
InChIKeyORKOEXDOADOBHK-UHFFFAOYSA-N
XLogP0.79
TPSA47.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-ethyl-2-methoxy-2-methylpropanimidamide?
The IUPAC name of N'-ethyl-2-methoxy-2-methylpropanimidamide (CID 79197267) is N'-ethyl-2-methoxy-2-methylpropanimidamide.
What is the SMILES notation for N'-ethyl-2-methoxy-2-methylpropanimidamide?
The canonical SMILES for N'-ethyl-2-methoxy-2-methylpropanimidamide is CC/N=C(\N)C(C)(C)OC.
What is the InChIKey of N'-ethyl-2-methoxy-2-methylpropanimidamide?
The InChIKey is ORKOEXDOADOBHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O/c1-5-9-6(8)7(2,3)10-4/h5H2,1-4H3,(H2,8,9).
What are the key properties of N'-ethyl-2-methoxy-2-methylpropanimidamide?
N'-ethyl-2-methoxy-2-methylpropanimidamide has a molecular weight of 144.22 g/mol, XLogP of 0.79, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-2-methoxy-2-methylpropanimidamide is sourced from PubChem (CID 79197267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).