N-[(Z)-(2,4-diethoxyphenyl)methylideneamino]-4-ethoxybenzamide

C20H24N2O4 — CID 29148688

IUPACN-[(Z)-(2,4-diethoxyphenyl)methylideneamino]-4-ethoxybenzamide
SMILESCCOc1ccc(C(=O)N/N=C\c2ccc(OCC)cc2OCC)cc1
InChIInChI=1S/C20H24N2O4/c1-4-24-17-10-7-15(8-11-17)20(23)22-21-14-16-9-12-18(25-5-2)13-19(16)26-6-3/h7-14H,4-6H2,1-3H3,(H,22,23)/b21-14-
InChIKeyYQNKGFLDIASOSG-STZFKDTASA-N
MW356.42 g/mol
LogP3.65
Rot. Bonds9

About N-[(Z)-(2,4-diethoxyphenyl)methylideneamino]-4-ethoxybenzamide

N-[(Z)-(2,4-diethoxyphenyl)methylideneamino]-4-ethoxybenzamide (PubChem CID 29148688) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is N-[(Z)-(2,4-diethoxyphenyl)methylideneamino]-4-ethoxybenzamide.

Molecular Properties

Compound NameN-[(Z)-(2,4-diethoxyphenyl)methylideneamino]-4-ethoxybenzamide
PubChem CID29148688
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC NameN-[(Z)-(2,4-diethoxyphenyl)methylideneamino]-4-ethoxybenzamide
SMILESCCOc1ccc(C(=O)N/N=C\c2ccc(OCC)cc2OCC)cc1
InChIInChI=1S/C20H24N2O4/c1-4-24-17-10-7-15(8-11-17)20(23)22-21-14-16-9-12-18(25-5-2)13-19(16)26-6-3/h7-14H,4-6H2,1-3H3,(H,22,23)/b21-14-
InChIKeyYQNKGFLDIASOSG-STZFKDTASA-N
XLogP3.65
TPSA69.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 53.65
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-[(E)-(5-chloro-2-ethoxyphenyl)methylideneamino]-4-ethoxybenzamide
CID 17246115
4-ethoxy-N-[(E)-(3-ethoxy-2-hydroxyphenyl)methylideneamino]benzamide
CID 135702023
N-[(E)-(2,4-diethoxyphenyl)methylideneamino]-2-methylbenzamide
CID 19060943
2-chloro-N-[(Z)-(2,4-diethoxyphenyl)methylideneamino]benzamide
CID 110509275
N-[(Z)-(2,4-dipropoxyphenyl)methylideneamino]-4-[(4-ethoxyphenyl)sulfonylamino]benzamide
CID 6181869
2-bromo-N-[(Z)-(2,4-diethoxyphenyl)methylideneamino]benzamide
CID 29146958
1-N,4-N-bis[(4-ethoxyphenyl)methylideneamino]benzene-1,4-dicarboxamide
CID 4674929
4-bromo-N-[(Z)-(4-ethoxy-2-hydroxyphenyl)methylideneamino]benzamide
CID 135504175
2-chloro-N-[(Z)-(2,4-diethoxyphenyl)methylideneamino]-4-methylbenzamide
CID 126060130
N'-[(Z)-(2,4-diethoxyphenyl)methylideneamino]-N-propan-2-yloxamide
CID 8899053
N-[(E)-(4-ethoxy-2-hydroxyphenyl)methylideneamino]-3,4-dimethoxybenzamide
CID 135998435
2-chloro-N-[(2,4-diethoxyphenyl)methylideneamino]pyridine-3-carboxamide
CID 3933448

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-(2,4-diethoxyphenyl)methylideneamino]-4-ethoxybenzamide?
The IUPAC name of N-[(Z)-(2,4-diethoxyphenyl)methylideneamino]-4-ethoxybenzamide (CID 29148688) is N-[(Z)-(2,4-diethoxyphenyl)methylideneamino]-4-ethoxybenzamide.
What is the SMILES notation for N-[(Z)-(2,4-diethoxyphenyl)methylideneamino]-4-ethoxybenzamide?
The canonical SMILES for N-[(Z)-(2,4-diethoxyphenyl)methylideneamino]-4-ethoxybenzamide is CCOc1ccc(C(=O)N/N=C\c2ccc(OCC)cc2OCC)cc1.
What is the InChIKey of N-[(Z)-(2,4-diethoxyphenyl)methylideneamino]-4-ethoxybenzamide?
The InChIKey is YQNKGFLDIASOSG-STZFKDTASA-N. The full InChI is InChI=1S/C20H24N2O4/c1-4-24-17-10-7-15(8-11-17)20(23)22-21-14-16-9-12-18(25-5-2)13-19(16)26-6-3/h7-14H,4-6H2,1-3H3,(H,22,23)/b21-14-.
What are the key properties of N-[(Z)-(2,4-diethoxyphenyl)methylideneamino]-4-ethoxybenzamide?
N-[(Z)-(2,4-diethoxyphenyl)methylideneamino]-4-ethoxybenzamide has a molecular weight of 356.42 g/mol, XLogP of 3.65, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-(2,4-diethoxyphenyl)methylideneamino]-4-ethoxybenzamide is sourced from PubChem (CID 29148688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).