N-[(Z)-(3,4-dimethoxyphenyl)methylideneamino]-4-propoxybenzamide

C19H22N2O4 — CID 92658847

IUPACN-[(Z)-(3,4-dimethoxyphenyl)methylideneamino]-4-propoxybenzamide
SMILESCCCOc1ccc(C(=O)N/N=C\c2ccc(OC)c(OC)c2)cc1
InChIInChI=1S/C19H22N2O4/c1-4-11-25-16-8-6-15(7-9-16)19(22)21-20-13-14-5-10-17(23-2)18(12-14)24-3/h5-10,12-13H,4,11H2,1-3H3,(H,21,22)/b20-13-
InChIKeyRQESZACFHQRJHV-MOSHPQCFSA-N
MW342.40 g/mol
LogP3.26
Rot. Bonds8

About N-[(Z)-(3,4-dimethoxyphenyl)methylideneamino]-4-propoxybenzamide

N-[(Z)-(3,4-dimethoxyphenyl)methylideneamino]-4-propoxybenzamide (PubChem CID 92658847) has the molecular formula C19H22N2O4 and a molecular weight of 342.40 g/mol. Its IUPAC name is N-[(Z)-(3,4-dimethoxyphenyl)methylideneamino]-4-propoxybenzamide.

Molecular Properties

Compound NameN-[(Z)-(3,4-dimethoxyphenyl)methylideneamino]-4-propoxybenzamide
PubChem CID92658847
Molecular FormulaC19H22N2O4
Molecular Weight342.40 g/mol
Exact Mass342.16
IUPAC NameN-[(Z)-(3,4-dimethoxyphenyl)methylideneamino]-4-propoxybenzamide
SMILESCCCOc1ccc(C(=O)N/N=C\c2ccc(OC)c(OC)c2)cc1
InChIInChI=1S/C19H22N2O4/c1-4-11-25-16-8-6-15(7-9-16)19(22)21-20-13-14-5-10-17(23-2)18(12-14)24-3/h5-10,12-13H,4,11H2,1-3H3,(H,21,22)/b20-13-
InChIKeyRQESZACFHQRJHV-MOSHPQCFSA-N
XLogP3.26
TPSA69.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 53.26
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'}

Analyze N-[(Z)-(3,4-dimethoxyphenyl)methylideneamino]-4-propoxybenzamide 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

[4-[(E)-[(4-tert-butylbenzoyl)hydrazinylidene]methyl]-2-methoxyphenyl] 4-propoxybenzoate
CID 51061998
N-[(E)-[4-(2-amino-2-oxoethoxy)phenyl]methylideneamino]-3-methoxy-4-propoxybenzamide
CID 126322296
4-amino-N-[(E)-(3-methoxy-4-propoxyphenyl)methylideneamino]benzamide
CID 6909799
4-propoxy-N-[(E)-(4-propoxyphenyl)methylideneamino]benzamide
CID 133169717
4-ethoxy-N-[(E)-(3-methoxy-4-pentoxyphenyl)methylideneamino]benzamide
CID 17373127
3-ethoxy-N-[(E)-(3-methoxy-4-propoxyphenyl)methylideneamino]-4-propoxybenzamide
CID 126324922
N-[(E)-(3-ethoxy-4-propoxyphenyl)methylideneamino]-3-methoxy-4-propoxybenzamide
CID 126326152
4-butoxy-N-[2-[2-[(3,4-dimethoxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]benzamide
CID 3470815
N-[(Z)-[3-methoxy-4-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]-4-propoxybenzamide
CID 92658857
[4-[(benzoylhydrazinylidene)methyl]-2-methoxyphenyl] 4-butoxybenzoate
CID 4061810
N-[(E)-(3-methoxy-4-propoxyphenyl)methylideneamino]pyridine-4-carboxamide
CID 6894142
[4-[[(4-butoxybenzoyl)hydrazinylidene]methyl]-2-methoxyphenyl] 4-chlorobenzoate
CID 5107096

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-(3,4-dimethoxyphenyl)methylideneamino]-4-propoxybenzamide?
The IUPAC name of N-[(Z)-(3,4-dimethoxyphenyl)methylideneamino]-4-propoxybenzamide (CID 92658847) is N-[(Z)-(3,4-dimethoxyphenyl)methylideneamino]-4-propoxybenzamide.
What is the SMILES notation for N-[(Z)-(3,4-dimethoxyphenyl)methylideneamino]-4-propoxybenzamide?
The canonical SMILES for N-[(Z)-(3,4-dimethoxyphenyl)methylideneamino]-4-propoxybenzamide is CCCOc1ccc(C(=O)N/N=C\c2ccc(OC)c(OC)c2)cc1.
What is the InChIKey of N-[(Z)-(3,4-dimethoxyphenyl)methylideneamino]-4-propoxybenzamide?
The InChIKey is RQESZACFHQRJHV-MOSHPQCFSA-N. The full InChI is InChI=1S/C19H22N2O4/c1-4-11-25-16-8-6-15(7-9-16)19(22)21-20-13-14-5-10-17(23-2)18(12-14)24-3/h5-10,12-13H,4,11H2,1-3H3,(H,21,22)/b20-13-.
What are the key properties of N-[(Z)-(3,4-dimethoxyphenyl)methylideneamino]-4-propoxybenzamide?
N-[(Z)-(3,4-dimethoxyphenyl)methylideneamino]-4-propoxybenzamide has a molecular weight of 342.40 g/mol, XLogP of 3.26, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-(3,4-dimethoxyphenyl)methylideneamino]-4-propoxybenzamide is sourced from PubChem (CID 92658847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).