phenyl 3-(4-methoxyphenoxy)-N-(4-methoxyphenyl)-2-methylprop-2-enimidate

C24H23NO4 — CID 59498400

IUPACphenyl 3-(4-methoxyphenoxy)-N-(4-methoxyphenyl)-2-methylprop-2-enimidate
SMILESCOc1ccc(/N=C(\Oc2ccccc2)C(C)=COc2ccc(OC)cc2)cc1
InChIInChI=1S/C24H23NO4/c1-18(17-28-22-15-13-21(27-3)14-16-22)24(29-23-7-5-4-6-8-23)25-19-9-11-20(26-2)12-10-19/h4-17H,1-3H3/b18-17?,25-24-
InChIKeyGOVOZRJRPYVRRS-JOGJSJOLSA-N
MW389.45 g/mol
LogP5.80
Rot. Bonds7

About phenyl 3-(4-methoxyphenoxy)-N-(4-methoxyphenyl)-2-methylprop-2-enimidate

phenyl 3-(4-methoxyphenoxy)-N-(4-methoxyphenyl)-2-methylprop-2-enimidate (PubChem CID 59498400) has the molecular formula C24H23NO4 and a molecular weight of 389.45 g/mol. Its IUPAC name is phenyl 3-(4-methoxyphenoxy)-N-(4-methoxyphenyl)-2-methylprop-2-enimidate.

Molecular Properties

Compound Namephenyl 3-(4-methoxyphenoxy)-N-(4-methoxyphenyl)-2-methylprop-2-enimidate
PubChem CID59498400
Molecular FormulaC24H23NO4
Molecular Weight389.45 g/mol
Exact Mass389.16
IUPAC Namephenyl 3-(4-methoxyphenoxy)-N-(4-methoxyphenyl)-2-methylprop-2-enimidate
SMILESCOc1ccc(/N=C(\Oc2ccccc2)C(C)=COc2ccc(OC)cc2)cc1
InChIInChI=1S/C24H23NO4/c1-18(17-28-22-15-13-21(27-3)14-16-22)24(29-23-7-5-4-6-8-23)25-19-9-11-20(26-2)12-10-19/h4-17H,1-3H3/b18-17?,25-24-
InChIKeyGOVOZRJRPYVRRS-JOGJSJOLSA-N
XLogP5.80
TPSA49.28 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500389.45
LogP ≤ 55.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'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 phenyl 3-(4-methoxyphenoxy)-N-(4-methoxyphenyl)-2-methylprop-2-enimidate?
The IUPAC name of phenyl 3-(4-methoxyphenoxy)-N-(4-methoxyphenyl)-2-methylprop-2-enimidate (CID 59498400) is phenyl 3-(4-methoxyphenoxy)-N-(4-methoxyphenyl)-2-methylprop-2-enimidate.
What is the SMILES notation for phenyl 3-(4-methoxyphenoxy)-N-(4-methoxyphenyl)-2-methylprop-2-enimidate?
The canonical SMILES for phenyl 3-(4-methoxyphenoxy)-N-(4-methoxyphenyl)-2-methylprop-2-enimidate is COc1ccc(/N=C(\Oc2ccccc2)C(C)=COc2ccc(OC)cc2)cc1.
What is the InChIKey of phenyl 3-(4-methoxyphenoxy)-N-(4-methoxyphenyl)-2-methylprop-2-enimidate?
The InChIKey is GOVOZRJRPYVRRS-JOGJSJOLSA-N. The full InChI is InChI=1S/C24H23NO4/c1-18(17-28-22-15-13-21(27-3)14-16-22)24(29-23-7-5-4-6-8-23)25-19-9-11-20(26-2)12-10-19/h4-17H,1-3H3/b18-17?,25-24-.
What are the key properties of phenyl 3-(4-methoxyphenoxy)-N-(4-methoxyphenyl)-2-methylprop-2-enimidate?
phenyl 3-(4-methoxyphenoxy)-N-(4-methoxyphenyl)-2-methylprop-2-enimidate has a molecular weight of 389.45 g/mol, XLogP of 5.80, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl 3-(4-methoxyphenoxy)-N-(4-methoxyphenyl)-2-methylprop-2-enimidate is sourced from PubChem (CID 59498400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).