3,4,5-triethoxy-N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]benzamide

C24H31N3O5 — CID 41082821

IUPAC3,4,5-triethoxy-N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]benzamide
SMILESCCOc1cc(C(=O)N/N=C\c2ccc(N3CCOCC3)cc2)cc(OCC)c1OCC
InChIInChI=1S/C24H31N3O5/c1-4-30-21-15-19(16-22(31-5-2)23(21)32-6-3)24(28)26-25-17-18-7-9-20(10-8-18)27-11-13-29-14-12-27/h7-10,15-17H,4-6,11-14H2,1-3H3,(H,26,28)/b25-17-
InChIKeyJUYMZCMVEGPVGS-UQQQWYQISA-N
MW441.53 g/mol
LogP3.48
Rot. Bonds10

About 3,4,5-triethoxy-N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]benzamide

3,4,5-triethoxy-N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]benzamide (PubChem CID 41082821) has the molecular formula C24H31N3O5 and a molecular weight of 441.53 g/mol. Its IUPAC name is 3,4,5-triethoxy-N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]benzamide.

Molecular Properties

Compound Name3,4,5-triethoxy-N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]benzamide
PubChem CID41082821
Molecular FormulaC24H31N3O5
Molecular Weight441.53 g/mol
Exact Mass441.23
IUPAC Name3,4,5-triethoxy-N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]benzamide
SMILESCCOc1cc(C(=O)N/N=C\c2ccc(N3CCOCC3)cc2)cc(OCC)c1OCC
InChIInChI=1S/C24H31N3O5/c1-4-30-21-15-19(16-22(31-5-2)23(21)32-6-3)24(28)26-25-17-18-7-9-20(10-8-18)27-11-13-29-14-12-27/h7-10,15-17H,4-6,11-14H2,1-3H3,(H,26,28)/b25-17-
InChIKeyJUYMZCMVEGPVGS-UQQQWYQISA-N
XLogP3.48
TPSA81.62 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds10
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500441.53
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 3,4,5-triethoxy-N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(E)-(4-hydroxyphenyl)methylideneamino]-4-morpholin-4-ylbenzamide
CID 135932618
4-ethoxy-N-[(E)-(3-fluoro-4-morpholin-4-ylphenyl)methylideneamino]benzamide
CID 17246516
N-[(4-ethoxyphenyl)methylideneamino]-4-(morpholin-4-ylmethyl)benzamide
CID 3647150
N-[(E)-(4-morpholin-4-ylphenyl)methylideneamino]-4-(piperidin-1-ylmethyl)benzamide
CID 145127992
4-bromo-N-[(E)-[3-ethoxy-4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]methylideneamino]benzamide
CID 126020485
6-amino-N-[(E)-(4-morpholin-4-ylphenyl)methylideneamino]pyridine-3-carboxamide
CID 170647589
2-(2-methoxyphenoxy)-N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]acetamide
CID 7965556
N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]-4-(quinolin-8-yloxymethyl)benzamide
CID 6072663
N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]-3-nitrobenzamide
CID 6073510
tert-butyl N-[(4-morpholin-4-ylphenyl)methylideneamino]carbamate
CID 2692504
N-[[4-[benzyl(ethyl)amino]phenyl]methylideneamino]-3,4,5-triethoxybenzamide
CID 4281813
2-(5-methyl-2-propan-2-ylphenoxy)-N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]acetamide
CID 6219369

Frequently Asked Questions

What is the IUPAC name of 3,4,5-triethoxy-N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]benzamide?
The IUPAC name of 3,4,5-triethoxy-N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]benzamide (CID 41082821) is 3,4,5-triethoxy-N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]benzamide.
What is the SMILES notation for 3,4,5-triethoxy-N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]benzamide?
The canonical SMILES for 3,4,5-triethoxy-N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]benzamide is CCOc1cc(C(=O)N/N=C\c2ccc(N3CCOCC3)cc2)cc(OCC)c1OCC.
What is the InChIKey of 3,4,5-triethoxy-N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]benzamide?
The InChIKey is JUYMZCMVEGPVGS-UQQQWYQISA-N. The full InChI is InChI=1S/C24H31N3O5/c1-4-30-21-15-19(16-22(31-5-2)23(21)32-6-3)24(28)26-25-17-18-7-9-20(10-8-18)27-11-13-29-14-12-27/h7-10,15-17H,4-6,11-14H2,1-3H3,(H,26,28)/b25-17-.
What are the key properties of 3,4,5-triethoxy-N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]benzamide?
3,4,5-triethoxy-N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]benzamide has a molecular weight of 441.53 g/mol, XLogP of 3.48, 10 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,5-triethoxy-N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]benzamide is sourced from PubChem (CID 41082821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).