N-[(Z)-(2-ethoxyphenyl)methylideneamino]-2,4-dimethoxybenzamide

C18H20N2O4 — CID 6272851

IUPACN-[(Z)-(2-ethoxyphenyl)methylideneamino]-2,4-dimethoxybenzamide
SMILESCCOc1ccccc1/C=N\NC(=O)c1ccc(OC)cc1OC
InChIInChI=1S/C18H20N2O4/c1-4-24-16-8-6-5-7-13(16)12-19-20-18(21)15-10-9-14(22-2)11-17(15)23-3/h5-12H,4H2,1-3H3,(H,20,21)/b19-12-
InChIKeyVWQZCOLQVMCMOB-UNOMPAQXSA-N
MW328.37 g/mol
LogP2.87
Rot. Bonds7

About N-[(Z)-(2-ethoxyphenyl)methylideneamino]-2,4-dimethoxybenzamide

N-[(Z)-(2-ethoxyphenyl)methylideneamino]-2,4-dimethoxybenzamide (PubChem CID 6272851) has the molecular formula C18H20N2O4 and a molecular weight of 328.37 g/mol. Its IUPAC name is N-[(Z)-(2-ethoxyphenyl)methylideneamino]-2,4-dimethoxybenzamide.

Molecular Properties

Compound NameN-[(Z)-(2-ethoxyphenyl)methylideneamino]-2,4-dimethoxybenzamide
PubChem CID6272851
Molecular FormulaC18H20N2O4
Molecular Weight328.37 g/mol
Exact Mass328.14
IUPAC NameN-[(Z)-(2-ethoxyphenyl)methylideneamino]-2,4-dimethoxybenzamide
SMILESCCOc1ccccc1/C=N\NC(=O)c1ccc(OC)cc1OC
InChIInChI=1S/C18H20N2O4/c1-4-24-16-8-6-5-7-13(16)12-19-20-18(21)15-10-9-14(22-2)11-17(15)23-3/h5-12H,4H2,1-3H3,(H,20,21)/b19-12-
InChIKeyVWQZCOLQVMCMOB-UNOMPAQXSA-N
XLogP2.87
TPSA69.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
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

2,4-dimethoxy-N-[(2-phenylmethoxyphenyl)methylideneamino]benzamide
CID 4562741
N-[(Z)-(2,4-dimethoxyphenyl)methylideneamino]-2,4-dimethoxybenzamide
CID 6113425
N-[[2-[(3-chlorophenyl)methoxy]phenyl]methylideneamino]-2,4-dimethoxybenzamide
CID 4684451
2-ethoxy-N-[(Z)-[2-[(3-methoxyphenyl)methoxy]phenyl]methylideneamino]benzamide
CID 6028587
N-[(Z)-(4-ethoxy-3-methoxyphenyl)methylideneamino]-2,4-dimethoxybenzamide
CID 6134975
2,4-dimethoxy-N-[(Z)-[2-[(4-nitrophenyl)methoxy]phenyl]methylideneamino]benzamide
CID 6071759
N-[(2-ethoxyphenyl)methylideneamino]-2-propoxybenzamide
CID 4931430
N-[(E)-(3-ethoxy-2-hydroxyphenyl)methylideneamino]-2-methoxybenzamide
CID 135717463
N-[(3-ethoxy-2-hydroxyphenyl)methylideneamino]-2-methoxybenzamide
CID 3632483
N-[(2,4-dimethoxyphenyl)methylideneamino]-3-methoxynaphthalene-2-carboxamide
CID 3422870
5-bromo-2-ethoxy-N-[(2-methoxyphenyl)methylideneamino]benzamide
CID 4101486
2-chloro-N-[(2-ethoxyphenyl)methylideneamino]benzamide
CID 904314

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-(2-ethoxyphenyl)methylideneamino]-2,4-dimethoxybenzamide?
The IUPAC name of N-[(Z)-(2-ethoxyphenyl)methylideneamino]-2,4-dimethoxybenzamide (CID 6272851) is N-[(Z)-(2-ethoxyphenyl)methylideneamino]-2,4-dimethoxybenzamide.
What is the SMILES notation for N-[(Z)-(2-ethoxyphenyl)methylideneamino]-2,4-dimethoxybenzamide?
The canonical SMILES for N-[(Z)-(2-ethoxyphenyl)methylideneamino]-2,4-dimethoxybenzamide is CCOc1ccccc1/C=N\NC(=O)c1ccc(OC)cc1OC.
What is the InChIKey of N-[(Z)-(2-ethoxyphenyl)methylideneamino]-2,4-dimethoxybenzamide?
The InChIKey is VWQZCOLQVMCMOB-UNOMPAQXSA-N. The full InChI is InChI=1S/C18H20N2O4/c1-4-24-16-8-6-5-7-13(16)12-19-20-18(21)15-10-9-14(22-2)11-17(15)23-3/h5-12H,4H2,1-3H3,(H,20,21)/b19-12-.
What are the key properties of N-[(Z)-(2-ethoxyphenyl)methylideneamino]-2,4-dimethoxybenzamide?
N-[(Z)-(2-ethoxyphenyl)methylideneamino]-2,4-dimethoxybenzamide has a molecular weight of 328.37 g/mol, XLogP of 2.87, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-(2-ethoxyphenyl)methylideneamino]-2,4-dimethoxybenzamide is sourced from PubChem (CID 6272851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).