N-[1-(4-methoxyphenyl)ethylideneamino]-4-prop-2-enoxybenzamide

C19H20N2O3 — CID 4925777

IUPACN-[1-(4-methoxyphenyl)ethylideneamino]-4-prop-2-enoxybenzamide
SMILESC=CCOc1ccc(C(=O)NN=C(C)c2ccc(OC)cc2)cc1
InChIInChI=1S/C19H20N2O3/c1-4-13-24-18-11-7-16(8-12-18)19(22)21-20-14(2)15-5-9-17(23-3)10-6-15/h4-12H,1,13H2,2-3H3,(H,21,22)
InChIKeyVGTGPLYSKMDHCX-UHFFFAOYSA-N
MW324.38 g/mol
LogP3.41
Rot. Bonds7

About N-[1-(4-methoxyphenyl)ethylideneamino]-4-prop-2-enoxybenzamide

N-[1-(4-methoxyphenyl)ethylideneamino]-4-prop-2-enoxybenzamide (PubChem CID 4925777) has the molecular formula C19H20N2O3 and a molecular weight of 324.38 g/mol. Its IUPAC name is N-[1-(4-methoxyphenyl)ethylideneamino]-4-prop-2-enoxybenzamide.

Molecular Properties

Compound NameN-[1-(4-methoxyphenyl)ethylideneamino]-4-prop-2-enoxybenzamide
PubChem CID4925777
Molecular FormulaC19H20N2O3
Molecular Weight324.38 g/mol
Exact Mass324.15
IUPAC NameN-[1-(4-methoxyphenyl)ethylideneamino]-4-prop-2-enoxybenzamide
SMILESC=CCOc1ccc(C(=O)NN=C(C)c2ccc(OC)cc2)cc1
InChIInChI=1S/C19H20N2O3/c1-4-13-24-18-11-7-16(8-12-18)19(22)21-20-14(2)15-5-9-17(23-3)10-6-15/h4-12H,1,13H2,2-3H3,(H,21,22)
InChIKeyVGTGPLYSKMDHCX-UHFFFAOYSA-N
XLogP3.41
TPSA59.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-[1-(4-methoxyphenyl)ethylideneamino]-4-prop-2-enoxybenzamide 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)-1-phenylethylideneamino]-4-prop-2-enoxybenzamide
CID 6232405
N-[1-(4-hydroxyphenyl)ethylideneamino]-4-prop-2-enoxybenzamide
CID 4925771
N-[1-(4-aminophenyl)ethylideneamino]-4-prop-2-enoxybenzamide
CID 4925774
N-[1-(4-nitrophenyl)ethylideneamino]-4-prop-2-enoxybenzamide
CID 4925773
4-bromo-N-[(Z)-1-(4-methoxyphenyl)ethylideneamino]benzamide
CID 6062256
N-[(Z)-1-(4-methoxyphenyl)ethylideneamino]-4-phenylbenzamide
CID 5496134
N-(1-cyclopropylethylideneamino)-4-prop-2-enoxybenzamide
CID 4925730
N-[(Z)-1-(4-ethoxyphenyl)ethylideneamino]-3,5-dimethoxybenzamide
CID 9461201
N-[(E)-heptan-2-ylideneamino]-4-prop-2-enoxybenzamide
CID 54784631
N-[(Z)-1-[4-(2-anilino-2-oxoethoxy)phenyl]ethylideneamino]-4-methoxybenzamide
CID 9359242
N-[(Z)-1-[4-(difluoromethoxy)phenyl]ethylideneamino]-4-methoxybenzamide
CID 9359355
N,N'-bis[1-(4-methoxyphenyl)ethylideneamino]oxamide
CID 4100154

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methoxyphenyl)ethylideneamino]-4-prop-2-enoxybenzamide?
The IUPAC name of N-[1-(4-methoxyphenyl)ethylideneamino]-4-prop-2-enoxybenzamide (CID 4925777) is N-[1-(4-methoxyphenyl)ethylideneamino]-4-prop-2-enoxybenzamide.
What is the SMILES notation for N-[1-(4-methoxyphenyl)ethylideneamino]-4-prop-2-enoxybenzamide?
The canonical SMILES for N-[1-(4-methoxyphenyl)ethylideneamino]-4-prop-2-enoxybenzamide is C=CCOc1ccc(C(=O)NN=C(C)c2ccc(OC)cc2)cc1.
What is the InChIKey of N-[1-(4-methoxyphenyl)ethylideneamino]-4-prop-2-enoxybenzamide?
The InChIKey is VGTGPLYSKMDHCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3/c1-4-13-24-18-11-7-16(8-12-18)19(22)21-20-14(2)15-5-9-17(23-3)10-6-15/h4-12H,1,13H2,2-3H3,(H,21,22).
What are the key properties of N-[1-(4-methoxyphenyl)ethylideneamino]-4-prop-2-enoxybenzamide?
N-[1-(4-methoxyphenyl)ethylideneamino]-4-prop-2-enoxybenzamide has a molecular weight of 324.38 g/mol, XLogP of 3.41, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methoxyphenyl)ethylideneamino]-4-prop-2-enoxybenzamide is sourced from PubChem (CID 4925777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).