N-methoxy-2-(4-methoxyphenyl)-1-(2,3,4-trimethoxyphenyl)ethanimine

C19H23NO5 — CID 57400546

IUPACN-methoxy-2-(4-methoxyphenyl)-1-(2,3,4-trimethoxyphenyl)ethanimine
SMILESCON=C(Cc1ccc(OC)cc1)c1ccc(OC)c(OC)c1OC
InChIInChI=1S/C19H23NO5/c1-21-14-8-6-13(7-9-14)12-16(20-25-5)15-10-11-17(22-2)19(24-4)18(15)23-3/h6-11H,12H2,1-5H3
InChIKeyHNVUVPILHDYIBF-UHFFFAOYSA-N
MW345.40 g/mol
LogP3.31
Rot. Bonds8

About N-methoxy-2-(4-methoxyphenyl)-1-(2,3,4-trimethoxyphenyl)ethanimine

N-methoxy-2-(4-methoxyphenyl)-1-(2,3,4-trimethoxyphenyl)ethanimine (PubChem CID 57400546) has the molecular formula C19H23NO5 and a molecular weight of 345.40 g/mol. Its IUPAC name is N-methoxy-2-(4-methoxyphenyl)-1-(2,3,4-trimethoxyphenyl)ethanimine.

Molecular Properties

Compound NameN-methoxy-2-(4-methoxyphenyl)-1-(2,3,4-trimethoxyphenyl)ethanimine
PubChem CID57400546
Molecular FormulaC19H23NO5
Molecular Weight345.40 g/mol
Exact Mass345.16
IUPAC NameN-methoxy-2-(4-methoxyphenyl)-1-(2,3,4-trimethoxyphenyl)ethanimine
SMILESCON=C(Cc1ccc(OC)cc1)c1ccc(OC)c(OC)c1OC
InChIInChI=1S/C19H23NO5/c1-21-14-8-6-13(7-9-14)12-16(20-25-5)15-10-11-17(22-2)19(24-4)18(15)23-3/h6-11H,12H2,1-5H3
InChIKeyHNVUVPILHDYIBF-UHFFFAOYSA-N
XLogP3.31
TPSA58.51 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.40
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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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Related Compounds

(E)-N-methoxy-1-(4-methoxyphenyl)-2-phenylethanimine
CID 21473328
2-phenyl-1-(2,3,4-trimethoxyphenyl)ethanone
CID 14284964
N-[(2,3-dimethoxyphenyl)methyl]-2-(4-methoxyphenyl)acetamide
CID 46590636
3,4-dimethoxy-2-[(4-methoxyphenyl)methyl]benzoic acid
CID 11289635
(NE)-N-[1,2-bis(4-methoxyphenyl)ethylidene]hydroxylamine
CID 5402606
[3,4-dimethoxy-2-[2-(4-methoxyphenyl)ethyl]phenyl]methanol
CID 23043876
N'-hydroxy-2,3,4-trimethoxybenzenecarboximidamide
CID 43140206
1,2,3-trimethoxy-4-[(4-phenoxyphenyl)methyl]benzene
CID 54421334
[2-(4-methoxyanilino)-2-oxoethyl] 2,3,4-trimethoxybenzoate
CID 2522313
[(Z)-[1-amino-2-(4-methoxyphenyl)ethylidene]amino] 3,4,5-trimethoxybenzoate
CID 91972727
N-[(Z)-(2-bromo-3,4-dimethoxyphenyl)methylideneamino]-2-(4-methoxyphenyl)acetamide
CID 110515468
[(2R)-1-(4-methoxyphenyl)-1-oxopropan-2-yl] 2,3,4-trimethoxybenzoate
CID 7758501

Frequently Asked Questions

What is the IUPAC name of N-methoxy-2-(4-methoxyphenyl)-1-(2,3,4-trimethoxyphenyl)ethanimine?
The IUPAC name of N-methoxy-2-(4-methoxyphenyl)-1-(2,3,4-trimethoxyphenyl)ethanimine (CID 57400546) is N-methoxy-2-(4-methoxyphenyl)-1-(2,3,4-trimethoxyphenyl)ethanimine.
What is the SMILES notation for N-methoxy-2-(4-methoxyphenyl)-1-(2,3,4-trimethoxyphenyl)ethanimine?
The canonical SMILES for N-methoxy-2-(4-methoxyphenyl)-1-(2,3,4-trimethoxyphenyl)ethanimine is CON=C(Cc1ccc(OC)cc1)c1ccc(OC)c(OC)c1OC.
What is the InChIKey of N-methoxy-2-(4-methoxyphenyl)-1-(2,3,4-trimethoxyphenyl)ethanimine?
The InChIKey is HNVUVPILHDYIBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO5/c1-21-14-8-6-13(7-9-14)12-16(20-25-5)15-10-11-17(22-2)19(24-4)18(15)23-3/h6-11H,12H2,1-5H3.
What are the key properties of N-methoxy-2-(4-methoxyphenyl)-1-(2,3,4-trimethoxyphenyl)ethanimine?
N-methoxy-2-(4-methoxyphenyl)-1-(2,3,4-trimethoxyphenyl)ethanimine has a molecular weight of 345.40 g/mol, XLogP of 3.31, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-2-(4-methoxyphenyl)-1-(2,3,4-trimethoxyphenyl)ethanimine is sourced from PubChem (CID 57400546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).