(Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine

C11H15NO2 — CID 142977776

IUPAC(Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine
SMILESCCO/N=C(/C)c1ccc(OC)cc1
InChIInChI=1S/C11H15NO2/c1-4-14-12-9(2)10-5-7-11(13-3)8-6-10/h5-8H,4H2,1-3H3/b12-9-
InChIKeyASWFCXFYZJVCGC-XFXZXTDPSA-N
MW193.25 g/mol
LogP2.46
Rot. Bonds4

About (Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine

(Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine (PubChem CID 142977776) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is (Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine.

Molecular Properties

Compound Name(Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine
PubChem CID142977776
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name(Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine
SMILESCCO/N=C(/C)c1ccc(OC)cc1
InChIInChI=1S/C11H15NO2/c1-4-14-12-9(2)10-5-7-11(13-3)8-6-10/h5-8H,4H2,1-3H3/b12-9-
InChIKeyASWFCXFYZJVCGC-XFXZXTDPSA-N
XLogP2.46
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 ≤ 52.46
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 (Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine?
The IUPAC name of (Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine (CID 142977776) is (Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine.
What is the SMILES notation for (Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine?
The canonical SMILES for (Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine is CCO/N=C(/C)c1ccc(OC)cc1.
What is the InChIKey of (Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine?
The InChIKey is ASWFCXFYZJVCGC-XFXZXTDPSA-N. The full InChI is InChI=1S/C11H15NO2/c1-4-14-12-9(2)10-5-7-11(13-3)8-6-10/h5-8H,4H2,1-3H3/b12-9-.
What are the key properties of (Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine?
(Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine has a molecular weight of 193.25 g/mol, XLogP of 2.46, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-ethoxy-1-(4-methoxyphenyl)ethanimine is sourced from PubChem (CID 142977776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).