3,5-dimethoxy-N-[(Z)-1-(3-methoxyphenyl)ethylideneamino]benzamide

C18H20N2O4 — CID 9461084

IUPAC3,5-dimethoxy-N-[(Z)-1-(3-methoxyphenyl)ethylideneamino]benzamide
SMILESCOc1cc(OC)cc(C(=O)N/N=C(/C)c2cccc(OC)c2)c1
InChIInChI=1S/C18H20N2O4/c1-12(13-6-5-7-15(8-13)22-2)19-20-18(21)14-9-16(23-3)11-17(10-14)24-4/h5-11H,1-4H3,(H,20,21)/b19-12-
InChIKeyOQIHRTUQMPXWEM-UNOMPAQXSA-N
MW328.37 g/mol
LogP2.87
Rot. Bonds6

About 3,5-dimethoxy-N-[(Z)-1-(3-methoxyphenyl)ethylideneamino]benzamide

3,5-dimethoxy-N-[(Z)-1-(3-methoxyphenyl)ethylideneamino]benzamide (PubChem CID 9461084) has the molecular formula C18H20N2O4 and a molecular weight of 328.37 g/mol. Its IUPAC name is 3,5-dimethoxy-N-[(Z)-1-(3-methoxyphenyl)ethylideneamino]benzamide.

Molecular Properties

Compound Name3,5-dimethoxy-N-[(Z)-1-(3-methoxyphenyl)ethylideneamino]benzamide
PubChem CID9461084
Molecular FormulaC18H20N2O4
Molecular Weight328.37 g/mol
Exact Mass328.14
IUPAC Name3,5-dimethoxy-N-[(Z)-1-(3-methoxyphenyl)ethylideneamino]benzamide
SMILESCOc1cc(OC)cc(C(=O)N/N=C(/C)c2cccc(OC)c2)c1
InChIInChI=1S/C18H20N2O4/c1-12(13-6-5-7-15(8-13)22-2)19-20-18(21)14-9-16(23-3)11-17(10-14)24-4/h5-11H,1-4H3,(H,20,21)/b19-12-
InChIKeyOQIHRTUQMPXWEM-UNOMPAQXSA-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

3-methoxy-N-(1-phenylethylideneamino)benzamide
CID 955694
N-[1-(3-methoxyphenyl)ethylideneamino]pyridine-3-carboxamide
CID 4227241
[1-(3-methoxyphenyl)ethylideneamino]urea
CID 3676916
N-[1-(4-hydroxy-3-methoxyphenyl)ethylideneamino]-3-methoxybenzamide
CID 5076368
N-[1-(3-methoxyphenyl)ethylideneamino]-4-nitrobenzamide
CID 4185393
N-[(Z)-1-(3-methoxyphenyl)ethylideneamino]-2,5-dimethylfuran-3-carboxamide
CID 6131731
3-(4-fluorophenyl)-N-[1-(3-methoxyphenyl)ethylideneamino]-1H-pyrazole-5-carboxamide
CID 3879162
N-[3-[(Z)-N-[(3,5-dimethoxybenzoyl)amino]-C-methylcarbonimidoyl]phenyl]-5-methylthiophene-2-carboxamide
CID 5454915
N-[3-[N-[(3,5-dimethoxybenzoyl)amino]-C-methylcarbonimidoyl]phenyl]-5-methylthiophene-2-carboxamide
CID 1225544
N'-[(Z)-1-(3-methoxyphenyl)ethylideneamino]-N-propan-2-yloxamide
CID 9351520
N-[(Z)-1-(4-ethoxyphenyl)ethylideneamino]-3,5-dimethoxybenzamide
CID 9461201
3,5-dimethoxy-N-[(Z)-1-pyridin-2-ylethylideneamino]benzamide
CID 9461008

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethoxy-N-[(Z)-1-(3-methoxyphenyl)ethylideneamino]benzamide?
The IUPAC name of 3,5-dimethoxy-N-[(Z)-1-(3-methoxyphenyl)ethylideneamino]benzamide (CID 9461084) is 3,5-dimethoxy-N-[(Z)-1-(3-methoxyphenyl)ethylideneamino]benzamide.
What is the SMILES notation for 3,5-dimethoxy-N-[(Z)-1-(3-methoxyphenyl)ethylideneamino]benzamide?
The canonical SMILES for 3,5-dimethoxy-N-[(Z)-1-(3-methoxyphenyl)ethylideneamino]benzamide is COc1cc(OC)cc(C(=O)N/N=C(/C)c2cccc(OC)c2)c1.
What is the InChIKey of 3,5-dimethoxy-N-[(Z)-1-(3-methoxyphenyl)ethylideneamino]benzamide?
The InChIKey is OQIHRTUQMPXWEM-UNOMPAQXSA-N. The full InChI is InChI=1S/C18H20N2O4/c1-12(13-6-5-7-15(8-13)22-2)19-20-18(21)14-9-16(23-3)11-17(10-14)24-4/h5-11H,1-4H3,(H,20,21)/b19-12-.
What are the key properties of 3,5-dimethoxy-N-[(Z)-1-(3-methoxyphenyl)ethylideneamino]benzamide?
3,5-dimethoxy-N-[(Z)-1-(3-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 3,5-dimethoxy-N-[(Z)-1-(3-methoxyphenyl)ethylideneamino]benzamide is sourced from PubChem (CID 9461084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).