N'-[2-[(2-methylpropan-2-yl)oxy]propan-2-yl]-N-propan-2-ylmethanediimine

C11H22N2O — CID 139635755

IUPACN'-[2-[(2-methylpropan-2-yl)oxy]propan-2-yl]-N-propan-2-ylmethanediimine
SMILESCC(C)N=C=NC(C)(C)OC(C)(C)C
InChIInChI=1S/C11H22N2O/c1-9(2)12-8-13-11(6,7)14-10(3,4)5/h9H,1-7H3
InChIKeyBAKRCUIJMCBGBJ-UHFFFAOYSA-N
MW198.31 g/mol
LogP3.12
Rot. Bonds3

About N'-[2-[(2-methylpropan-2-yl)oxy]propan-2-yl]-N-propan-2-ylmethanediimine

N'-[2-[(2-methylpropan-2-yl)oxy]propan-2-yl]-N-propan-2-ylmethanediimine (PubChem CID 139635755) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is N'-[2-[(2-methylpropan-2-yl)oxy]propan-2-yl]-N-propan-2-ylmethanediimine.

Molecular Properties

Compound NameN'-[2-[(2-methylpropan-2-yl)oxy]propan-2-yl]-N-propan-2-ylmethanediimine
PubChem CID139635755
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC NameN'-[2-[(2-methylpropan-2-yl)oxy]propan-2-yl]-N-propan-2-ylmethanediimine
SMILESCC(C)N=C=NC(C)(C)OC(C)(C)C
InChIInChI=1S/C11H22N2O/c1-9(2)12-8-13-11(6,7)14-10(3,4)5/h9H,1-7H3
InChIKeyBAKRCUIJMCBGBJ-UHFFFAOYSA-N
XLogP3.12
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-[2-[(2-methylpropan-2-yl)oxy]propan-2-yl]-N-propan-2-ylmethanediimine?
The IUPAC name of N'-[2-[(2-methylpropan-2-yl)oxy]propan-2-yl]-N-propan-2-ylmethanediimine (CID 139635755) is N'-[2-[(2-methylpropan-2-yl)oxy]propan-2-yl]-N-propan-2-ylmethanediimine.
What is the SMILES notation for N'-[2-[(2-methylpropan-2-yl)oxy]propan-2-yl]-N-propan-2-ylmethanediimine?
The canonical SMILES for N'-[2-[(2-methylpropan-2-yl)oxy]propan-2-yl]-N-propan-2-ylmethanediimine is CC(C)N=C=NC(C)(C)OC(C)(C)C.
What is the InChIKey of N'-[2-[(2-methylpropan-2-yl)oxy]propan-2-yl]-N-propan-2-ylmethanediimine?
The InChIKey is BAKRCUIJMCBGBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-9(2)12-8-13-11(6,7)14-10(3,4)5/h9H,1-7H3.
What are the key properties of N'-[2-[(2-methylpropan-2-yl)oxy]propan-2-yl]-N-propan-2-ylmethanediimine?
N'-[2-[(2-methylpropan-2-yl)oxy]propan-2-yl]-N-propan-2-ylmethanediimine has a molecular weight of 198.31 g/mol, XLogP of 3.12, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-[(2-methylpropan-2-yl)oxy]propan-2-yl]-N-propan-2-ylmethanediimine is sourced from PubChem (CID 139635755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).