(E)-1-(4-methoxy-3-phenylmethoxyphenyl)-N-morpholin-4-ylmethanimine

C19H22N2O3 — CID 6902616

IUPAC(E)-1-(4-methoxy-3-phenylmethoxyphenyl)-N-morpholin-4-ylmethanimine
SMILESCOc1ccc(/C=N/N2CCOCC2)cc1OCc1ccccc1
InChIInChI=1S/C19H22N2O3/c1-22-18-8-7-17(14-20-21-9-11-23-12-10-21)13-19(18)24-15-16-5-3-2-4-6-16/h2-8,13-14H,9-12,15H2,1H3/b20-14+
InChIKeyGPEDSNPAMPROKO-XSFVSMFZSA-N
MW326.40 g/mol
LogP2.94
Rot. Bonds6

About (E)-1-(4-methoxy-3-phenylmethoxyphenyl)-N-morpholin-4-ylmethanimine

(E)-1-(4-methoxy-3-phenylmethoxyphenyl)-N-morpholin-4-ylmethanimine (PubChem CID 6902616) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is (E)-1-(4-methoxy-3-phenylmethoxyphenyl)-N-morpholin-4-ylmethanimine.

Molecular Properties

Compound Name(E)-1-(4-methoxy-3-phenylmethoxyphenyl)-N-morpholin-4-ylmethanimine
PubChem CID6902616
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC Name(E)-1-(4-methoxy-3-phenylmethoxyphenyl)-N-morpholin-4-ylmethanimine
SMILESCOc1ccc(/C=N/N2CCOCC2)cc1OCc1ccccc1
InChIInChI=1S/C19H22N2O3/c1-22-18-8-7-17(14-20-21-9-11-23-12-10-21)13-19(18)24-15-16-5-3-2-4-6-16/h2-8,13-14H,9-12,15H2,1H3/b20-14+
InChIKeyGPEDSNPAMPROKO-XSFVSMFZSA-N
XLogP2.94
TPSA43.29 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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 (E)-1-(4-methoxy-3-phenylmethoxyphenyl)-N-morpholin-4-ylmethanimine?
The IUPAC name of (E)-1-(4-methoxy-3-phenylmethoxyphenyl)-N-morpholin-4-ylmethanimine (CID 6902616) is (E)-1-(4-methoxy-3-phenylmethoxyphenyl)-N-morpholin-4-ylmethanimine.
What is the SMILES notation for (E)-1-(4-methoxy-3-phenylmethoxyphenyl)-N-morpholin-4-ylmethanimine?
The canonical SMILES for (E)-1-(4-methoxy-3-phenylmethoxyphenyl)-N-morpholin-4-ylmethanimine is COc1ccc(/C=N/N2CCOCC2)cc1OCc1ccccc1.
What is the InChIKey of (E)-1-(4-methoxy-3-phenylmethoxyphenyl)-N-morpholin-4-ylmethanimine?
The InChIKey is GPEDSNPAMPROKO-XSFVSMFZSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-22-18-8-7-17(14-20-21-9-11-23-12-10-21)13-19(18)24-15-16-5-3-2-4-6-16/h2-8,13-14H,9-12,15H2,1H3/b20-14+.
What are the key properties of (E)-1-(4-methoxy-3-phenylmethoxyphenyl)-N-morpholin-4-ylmethanimine?
(E)-1-(4-methoxy-3-phenylmethoxyphenyl)-N-morpholin-4-ylmethanimine has a molecular weight of 326.40 g/mol, XLogP of 2.94, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-(4-methoxy-3-phenylmethoxyphenyl)-N-morpholin-4-ylmethanimine is sourced from PubChem (CID 6902616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).