N-[(E)-[3-methoxy-2-[(E)-3-phenylprop-2-enoxy]phenyl]methylideneamino]propanamide

C20H22N2O3 — CID 29057465

IUPACN-[(E)-[3-methoxy-2-[(E)-3-phenylprop-2-enoxy]phenyl]methylideneamino]propanamide
SMILESCCC(=O)N/N=C/c1cccc(OC)c1OC/C=C/c1ccccc1
InChIInChI=1S/C20H22N2O3/c1-3-19(23)22-21-15-17-12-7-13-18(24-2)20(17)25-14-8-11-16-9-5-4-6-10-16/h4-13,15H,3,14H2,1-2H3,(H,22,23)/b11-8+,21-15+
InChIKeyDMBRIIJDZZOVNN-PRHRNWNNSA-N
MW338.41 g/mol
LogP3.65
Rot. Bonds8

About N-[(E)-[3-methoxy-2-[(E)-3-phenylprop-2-enoxy]phenyl]methylideneamino]propanamide

N-[(E)-[3-methoxy-2-[(E)-3-phenylprop-2-enoxy]phenyl]methylideneamino]propanamide (PubChem CID 29057465) has the molecular formula C20H22N2O3 and a molecular weight of 338.41 g/mol. Its IUPAC name is N-[(E)-[3-methoxy-2-[(E)-3-phenylprop-2-enoxy]phenyl]methylideneamino]propanamide.

Molecular Properties

Compound NameN-[(E)-[3-methoxy-2-[(E)-3-phenylprop-2-enoxy]phenyl]methylideneamino]propanamide
PubChem CID29057465
Molecular FormulaC20H22N2O3
Molecular Weight338.41 g/mol
Exact Mass338.16
IUPAC NameN-[(E)-[3-methoxy-2-[(E)-3-phenylprop-2-enoxy]phenyl]methylideneamino]propanamide
SMILESCCC(=O)N/N=C/c1cccc(OC)c1OC/C=C/c1ccccc1
InChIInChI=1S/C20H22N2O3/c1-3-19(23)22-21-15-17-12-7-13-18(24-2)20(17)25-14-8-11-16-9-5-4-6-10-16/h4-13,15H,3,14H2,1-2H3,(H,22,23)/b11-8+,21-15+
InChIKeyDMBRIIJDZZOVNN-PRHRNWNNSA-N
XLogP3.65
TPSA59.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-[(E)-[3-methoxy-2-[(E)-3-phenylprop-2-enoxy]phenyl]methylideneamino]propanamide 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

ethyl N-[(Z)-[3-methoxy-2-[(E)-3-phenylprop-2-enoxy]phenyl]methylideneamino]carbamate
CID 25237295
N-[(E)-(2-ethoxy-3-methoxyphenyl)methylideneamino]pentanamide
CID 110506839
N-(2-chlorophenyl)-N'-[(2-ethoxy-3-methoxyphenyl)methylideneamino]propanediamide
CID 5111842
N'-[(2-ethoxy-3-methoxyphenyl)methylideneamino]-N-(4-methoxyphenyl)propanediamide
CID 5115888
N-[(Z)-[3-methoxy-4-[(E)-3-phenylprop-2-enoxy]phenyl]methylideneamino]acetamide
CID 25237262
N-[(Z)-(3-ethoxy-2-methoxyphenyl)methylideneamino]-2-phenylacetamide
CID 110515359
N-[(E)-(2,3-dimethoxyphenyl)methylideneamino]tetradecanamide
CID 51060988
2-methoxy-N-[(E)-(3-methoxy-2-propoxyphenyl)methylideneamino]benzamide
CID 110505829
N-[(4-methoxynaphthalen-1-yl)methylideneamino]-2-naphthalen-1-yloxyacetamide
CID 5191002
N-[(2,3-dimethoxyphenyl)methylideneamino]-4-(propanoylamino)benzamide
CID 4981059
N-[(E)-(2,3-dimethoxyphenyl)methylideneamino]-2-(2-fluorophenoxy)acetamide
CID 6911040
N-[(Z)-(2-ethoxy-3-methoxyphenyl)methylideneamino]-2-hydroxybenzamide
CID 110509480

Frequently Asked Questions

What is the IUPAC name of N-[(E)-[3-methoxy-2-[(E)-3-phenylprop-2-enoxy]phenyl]methylideneamino]propanamide?
The IUPAC name of N-[(E)-[3-methoxy-2-[(E)-3-phenylprop-2-enoxy]phenyl]methylideneamino]propanamide (CID 29057465) is N-[(E)-[3-methoxy-2-[(E)-3-phenylprop-2-enoxy]phenyl]methylideneamino]propanamide.
What is the SMILES notation for N-[(E)-[3-methoxy-2-[(E)-3-phenylprop-2-enoxy]phenyl]methylideneamino]propanamide?
The canonical SMILES for N-[(E)-[3-methoxy-2-[(E)-3-phenylprop-2-enoxy]phenyl]methylideneamino]propanamide is CCC(=O)N/N=C/c1cccc(OC)c1OC/C=C/c1ccccc1.
What is the InChIKey of N-[(E)-[3-methoxy-2-[(E)-3-phenylprop-2-enoxy]phenyl]methylideneamino]propanamide?
The InChIKey is DMBRIIJDZZOVNN-PRHRNWNNSA-N. The full InChI is InChI=1S/C20H22N2O3/c1-3-19(23)22-21-15-17-12-7-13-18(24-2)20(17)25-14-8-11-16-9-5-4-6-10-16/h4-13,15H,3,14H2,1-2H3,(H,22,23)/b11-8+,21-15+.
What are the key properties of N-[(E)-[3-methoxy-2-[(E)-3-phenylprop-2-enoxy]phenyl]methylideneamino]propanamide?
N-[(E)-[3-methoxy-2-[(E)-3-phenylprop-2-enoxy]phenyl]methylideneamino]propanamide has a molecular weight of 338.41 g/mol, XLogP of 3.65, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-[3-methoxy-2-[(E)-3-phenylprop-2-enoxy]phenyl]methylideneamino]propanamide is sourced from PubChem (CID 29057465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).