(E)-1-(3,4-dimethoxyphenyl)-N-morpholin-4-ylethanimine

C14H20N2O3 — CID 75361321

IUPAC(E)-1-(3,4-dimethoxyphenyl)-N-morpholin-4-ylethanimine
SMILESCOc1ccc(/C(C)=N/N2CCOCC2)cc1OC
InChIInChI=1S/C14H20N2O3/c1-11(15-16-6-8-19-9-7-16)12-4-5-13(17-2)14(10-12)18-3/h4-5,10H,6-9H2,1-3H3/b15-11+
InChIKeyANKGYPPZWCWRHH-RVDMUPIBSA-N
MW264.32 g/mol
LogP1.76
Rot. Bonds4

About (E)-1-(3,4-dimethoxyphenyl)-N-morpholin-4-ylethanimine

(E)-1-(3,4-dimethoxyphenyl)-N-morpholin-4-ylethanimine (PubChem CID 75361321) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is (E)-1-(3,4-dimethoxyphenyl)-N-morpholin-4-ylethanimine.

Molecular Properties

Compound Name(E)-1-(3,4-dimethoxyphenyl)-N-morpholin-4-ylethanimine
PubChem CID75361321
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name(E)-1-(3,4-dimethoxyphenyl)-N-morpholin-4-ylethanimine
SMILESCOc1ccc(/C(C)=N/N2CCOCC2)cc1OC
InChIInChI=1S/C14H20N2O3/c1-11(15-16-6-8-19-9-7-16)12-4-5-13(17-2)14(10-12)18-3/h4-5,10H,6-9H2,1-3H3/b15-11+
InChIKeyANKGYPPZWCWRHH-RVDMUPIBSA-N
XLogP1.76
TPSA43.29 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

(E)-1-(3,4-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)ethanimine
CID 43019174
1-(2,3-dihydro-1H-inden-5-yl)-N-morpholin-4-ylethanimine
CID 71943522
(3,4-dimethoxyphenyl)-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)methanone
CID 4600615
1-(3,4-dimethoxyphenyl)-N-(2,6-dimethylpiperidin-1-yl)ethanimine
CID 23996321
(Z)-1-(9H-fluoren-2-yl)-N-morpholin-4-ylethanimine
CID 167952207
1-[(Z)-1-(3,4-dimethoxyphenyl)ethylideneamino]-3-(3-morpholin-4-ylpropyl)thiourea
CID 9411591
hydron;2-morpholin-4-ylethyl 3,4-dimethoxybenzoate;chloride
CID 660605
3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzoic acid
CID 2363825
N-[(E)-1-(3,4-dimethoxyphenyl)ethylideneamino]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide
CID 42995329
(2S,3S)-1-(3,4-dimethoxyphenyl)-2-hydroxy-3-(4-methylphenyl)-3-morpholin-4-ylpropan-1-one
CID 1481576
3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-2-morpholin-4-ylprop-2-enamide
CID 67584480
1-morpholin-4-ylpropan-2-yl 3,4-dimethoxybenzoate chloride
CID 53312685

Frequently Asked Questions

What is the IUPAC name of (E)-1-(3,4-dimethoxyphenyl)-N-morpholin-4-ylethanimine?
The IUPAC name of (E)-1-(3,4-dimethoxyphenyl)-N-morpholin-4-ylethanimine (CID 75361321) is (E)-1-(3,4-dimethoxyphenyl)-N-morpholin-4-ylethanimine.
What is the SMILES notation for (E)-1-(3,4-dimethoxyphenyl)-N-morpholin-4-ylethanimine?
The canonical SMILES for (E)-1-(3,4-dimethoxyphenyl)-N-morpholin-4-ylethanimine is COc1ccc(/C(C)=N/N2CCOCC2)cc1OC.
What is the InChIKey of (E)-1-(3,4-dimethoxyphenyl)-N-morpholin-4-ylethanimine?
The InChIKey is ANKGYPPZWCWRHH-RVDMUPIBSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-11(15-16-6-8-19-9-7-16)12-4-5-13(17-2)14(10-12)18-3/h4-5,10H,6-9H2,1-3H3/b15-11+.
What are the key properties of (E)-1-(3,4-dimethoxyphenyl)-N-morpholin-4-ylethanimine?
(E)-1-(3,4-dimethoxyphenyl)-N-morpholin-4-ylethanimine has a molecular weight of 264.32 g/mol, XLogP of 1.76, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-(3,4-dimethoxyphenyl)-N-morpholin-4-ylethanimine is sourced from PubChem (CID 75361321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).