N-methoxy-1-(2-propan-2-yloxyphenyl)methanimine

C11H15NO2 — CID 73094502

IUPACN-methoxy-1-(2-propan-2-yloxyphenyl)methanimine
SMILESCON=Cc1ccccc1OC(C)C
InChIInChI=1S/C11H15NO2/c1-9(2)14-11-7-5-4-6-10(11)8-12-13-3/h4-9H,1-3H3
InChIKeyJCBUKLFOJIWOER-UHFFFAOYSA-N
MW193.25 g/mol
LogP2.45
Rot. Bonds4

About N-methoxy-1-(2-propan-2-yloxyphenyl)methanimine

N-methoxy-1-(2-propan-2-yloxyphenyl)methanimine (PubChem CID 73094502) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is N-methoxy-1-(2-propan-2-yloxyphenyl)methanimine.

Molecular Properties

Compound NameN-methoxy-1-(2-propan-2-yloxyphenyl)methanimine
PubChem CID73094502
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC NameN-methoxy-1-(2-propan-2-yloxyphenyl)methanimine
SMILESCON=Cc1ccccc1OC(C)C
InChIInChI=1S/C11H15NO2/c1-9(2)14-11-7-5-4-6-10(11)8-12-13-3/h4-9H,1-3H3
InChIKeyJCBUKLFOJIWOER-UHFFFAOYSA-N
XLogP2.45
TPSA30.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-methoxy-1-(2-propan-2-yloxyphenyl)methanimine?
The IUPAC name of N-methoxy-1-(2-propan-2-yloxyphenyl)methanimine (CID 73094502) is N-methoxy-1-(2-propan-2-yloxyphenyl)methanimine.
What is the SMILES notation for N-methoxy-1-(2-propan-2-yloxyphenyl)methanimine?
The canonical SMILES for N-methoxy-1-(2-propan-2-yloxyphenyl)methanimine is CON=Cc1ccccc1OC(C)C.
What is the InChIKey of N-methoxy-1-(2-propan-2-yloxyphenyl)methanimine?
The InChIKey is JCBUKLFOJIWOER-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-9(2)14-11-7-5-4-6-10(11)8-12-13-3/h4-9H,1-3H3.
What are the key properties of N-methoxy-1-(2-propan-2-yloxyphenyl)methanimine?
N-methoxy-1-(2-propan-2-yloxyphenyl)methanimine has a molecular weight of 193.25 g/mol, XLogP of 2.45, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-1-(2-propan-2-yloxyphenyl)methanimine is sourced from PubChem (CID 73094502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).