2,4-dimethoxy-N-[1-(4-methoxyphenyl)ethylideneamino]benzamide

C18H20N2O4 — CID 873053

IUPAC2,4-dimethoxy-N-[1-(4-methoxyphenyl)ethylideneamino]benzamide
SMILESCOc1ccc(C(C)=NNC(=O)c2ccc(OC)cc2OC)cc1
InChIInChI=1S/C18H20N2O4/c1-12(13-5-7-14(22-2)8-6-13)19-20-18(21)16-10-9-15(23-3)11-17(16)24-4/h5-11H,1-4H3,(H,20,21)
InChIKeyHIXIQVKEVBLBBL-UHFFFAOYSA-N
MW328.37 g/mol
LogP2.87
Rot. Bonds6

About 2,4-dimethoxy-N-[1-(4-methoxyphenyl)ethylideneamino]benzamide

2,4-dimethoxy-N-[1-(4-methoxyphenyl)ethylideneamino]benzamide (PubChem CID 873053) has the molecular formula C18H20N2O4 and a molecular weight of 328.37 g/mol. Its IUPAC name is 2,4-dimethoxy-N-[1-(4-methoxyphenyl)ethylideneamino]benzamide.

Molecular Properties

Compound Name2,4-dimethoxy-N-[1-(4-methoxyphenyl)ethylideneamino]benzamide
PubChem CID873053
Molecular FormulaC18H20N2O4
Molecular Weight328.37 g/mol
Exact Mass328.14
IUPAC Name2,4-dimethoxy-N-[1-(4-methoxyphenyl)ethylideneamino]benzamide
SMILESCOc1ccc(C(C)=NNC(=O)c2ccc(OC)cc2OC)cc1
InChIInChI=1S/C18H20N2O4/c1-12(13-5-7-14(22-2)8-6-13)19-20-18(21)16-10-9-15(23-3)11-17(16)24-4/h5-11H,1-4H3,(H,20,21)
InChIKeyHIXIQVKEVBLBBL-UHFFFAOYSA-N
XLogP2.87
TPSA69.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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

N-[1-(4-ethylphenyl)ethylideneamino]-2,4-dimethoxybenzamide
CID 4224310
N-[1-(2,4-dimethoxyphenyl)ethylideneamino]-4-fluorobenzamide
CID 78596498
2,4-dimethoxy-N-[(Z)-1-[4-[(2-phenylacetyl)amino]phenyl]ethylideneamino]benzamide
CID 26871625
N-[(Z)-1-(2,5-dimethoxyphenyl)ethylideneamino]-4-methoxybenzamide
CID 9359358
4-amino-N-[(Z)-1-(2,4-dimethoxyphenyl)ethylideneamino]benzamide;oxalic acid
CID 163326318
2-hydroxy-4-methoxy-N-[(Z)-1-phenylethylideneamino]benzamide
CID 126396445
2,4-dichloro-N-[1-(2,4-dimethoxyphenyl)ethylideneamino]benzamide
CID 4507808
N-[1-(2,4-dimethoxyphenyl)ethylideneamino]-2-prop-2-enoxybenzamide
CID 4928995
3,4-dimethoxy-N-[(Z)-1-(6-methoxynaphthalen-2-yl)ethylideneamino]benzamide
CID 6180512
N,N'-bis[1-(4-methoxyphenyl)ethylideneamino]oxamide
CID 4100154
2-fluoro-N-[1-(4-methoxyphenyl)ethylideneamino]benzamide
CID 4200169
2-methoxy-N-[(Z)-1-(4-methylphenyl)ethylideneamino]benzamide
CID 6152790

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethoxy-N-[1-(4-methoxyphenyl)ethylideneamino]benzamide?
The IUPAC name of 2,4-dimethoxy-N-[1-(4-methoxyphenyl)ethylideneamino]benzamide (CID 873053) is 2,4-dimethoxy-N-[1-(4-methoxyphenyl)ethylideneamino]benzamide.
What is the SMILES notation for 2,4-dimethoxy-N-[1-(4-methoxyphenyl)ethylideneamino]benzamide?
The canonical SMILES for 2,4-dimethoxy-N-[1-(4-methoxyphenyl)ethylideneamino]benzamide is COc1ccc(C(C)=NNC(=O)c2ccc(OC)cc2OC)cc1.
What is the InChIKey of 2,4-dimethoxy-N-[1-(4-methoxyphenyl)ethylideneamino]benzamide?
The InChIKey is HIXIQVKEVBLBBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O4/c1-12(13-5-7-14(22-2)8-6-13)19-20-18(21)16-10-9-15(23-3)11-17(16)24-4/h5-11H,1-4H3,(H,20,21).
What are the key properties of 2,4-dimethoxy-N-[1-(4-methoxyphenyl)ethylideneamino]benzamide?
2,4-dimethoxy-N-[1-(4-methoxyphenyl)ethylideneamino]benzamide has a molecular weight of 328.37 g/mol, XLogP of 2.87, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethoxy-N-[1-(4-methoxyphenyl)ethylideneamino]benzamide is sourced from PubChem (CID 873053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).