N-[(Z)-(2,5-dimethylphenyl)methylideneamino]-4-(phenoxymethyl)benzamide

C23H22N2O2 — CID 8518266

IUPACN-[(Z)-(2,5-dimethylphenyl)methylideneamino]-4-(phenoxymethyl)benzamide
SMILESCc1ccc(C)c(/C=N\NC(=O)c2ccc(COc3ccccc3)cc2)c1
InChIInChI=1S/C23H22N2O2/c1-17-8-9-18(2)21(14-17)15-24-25-23(26)20-12-10-19(11-13-20)16-27-22-6-4-3-5-7-22/h3-15H,16H2,1-2H3,(H,25,26)/b24-15-
InChIKeyXECCCQHPIBVVDI-IWIPYMOSSA-N
MW358.44 g/mol
LogP4.65
Rot. Bonds6

About N-[(Z)-(2,5-dimethylphenyl)methylideneamino]-4-(phenoxymethyl)benzamide

N-[(Z)-(2,5-dimethylphenyl)methylideneamino]-4-(phenoxymethyl)benzamide (PubChem CID 8518266) has the molecular formula C23H22N2O2 and a molecular weight of 358.44 g/mol. Its IUPAC name is N-[(Z)-(2,5-dimethylphenyl)methylideneamino]-4-(phenoxymethyl)benzamide.

Molecular Properties

Compound NameN-[(Z)-(2,5-dimethylphenyl)methylideneamino]-4-(phenoxymethyl)benzamide
PubChem CID8518266
Molecular FormulaC23H22N2O2
Molecular Weight358.44 g/mol
Exact Mass358.17
IUPAC NameN-[(Z)-(2,5-dimethylphenyl)methylideneamino]-4-(phenoxymethyl)benzamide
SMILESCc1ccc(C)c(/C=N\NC(=O)c2ccc(COc3ccccc3)cc2)c1
InChIInChI=1S/C23H22N2O2/c1-17-8-9-18(2)21(14-17)15-24-25-23(26)20-12-10-19(11-13-20)16-27-22-6-4-3-5-7-22/h3-15H,16H2,1-2H3,(H,25,26)/b24-15-
InChIKeyXECCCQHPIBVVDI-IWIPYMOSSA-N
XLogP4.65
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.44
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-[(Z)-(2,5-dimethylphenyl)methylideneamino]-4-(phenoxymethyl)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-[(2-methylphenyl)methylideneamino]-4-phenylmethoxybenzamide
CID 4932964
N-[(Z)-(2,4-dimethylphenyl)methylideneamino]-4-(naphthalen-2-yloxymethyl)benzamide
CID 7928974
N-[(4-methylphenyl)methylideneamino]-4-phenylmethoxybenzamide
CID 4932926
4-methyl-N-[(Z)-[2-(phenoxymethyl)phenyl]methylideneamino]benzamide
CID 110509126
N-[(3-methylphenyl)methylideneamino]-4-phenylmethoxybenzamide
CID 4932966
[4-[(E)-[[4-[(4-methylphenyl)methoxy]benzoyl]hydrazinylidene]methyl]phenyl] benzoate
CID 45054705
N-[(Z)-(2-hydroxy-5-methoxyphenyl)methylideneamino]-4-[(4-methylphenyl)methoxy]benzamide
CID 136766907
2-[2-[(Z)-[[4-(phenoxymethyl)benzoyl]hydrazinylidene]methyl]phenoxy]acetate
CID 8518215
3-chloro-4-methyl-N-[(Z)-[2-[(4-methylphenyl)methoxy]phenyl]methylideneamino]benzamide
CID 126060693
3-bromo-4-methyl-N-[(4-phenylmethoxyphenyl)methylideneamino]benzamide
CID 5196695
N-[(Z)-benzylideneamino]-4-phenylmethoxybenzamide
CID 5401763
N-[(Z)-(2,6-dichlorophenyl)methylideneamino]-4-(phenoxymethyl)benzamide
CID 8518234

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-(2,5-dimethylphenyl)methylideneamino]-4-(phenoxymethyl)benzamide?
The IUPAC name of N-[(Z)-(2,5-dimethylphenyl)methylideneamino]-4-(phenoxymethyl)benzamide (CID 8518266) is N-[(Z)-(2,5-dimethylphenyl)methylideneamino]-4-(phenoxymethyl)benzamide.
What is the SMILES notation for N-[(Z)-(2,5-dimethylphenyl)methylideneamino]-4-(phenoxymethyl)benzamide?
The canonical SMILES for N-[(Z)-(2,5-dimethylphenyl)methylideneamino]-4-(phenoxymethyl)benzamide is Cc1ccc(C)c(/C=N\NC(=O)c2ccc(COc3ccccc3)cc2)c1.
What is the InChIKey of N-[(Z)-(2,5-dimethylphenyl)methylideneamino]-4-(phenoxymethyl)benzamide?
The InChIKey is XECCCQHPIBVVDI-IWIPYMOSSA-N. The full InChI is InChI=1S/C23H22N2O2/c1-17-8-9-18(2)21(14-17)15-24-25-23(26)20-12-10-19(11-13-20)16-27-22-6-4-3-5-7-22/h3-15H,16H2,1-2H3,(H,25,26)/b24-15-.
What are the key properties of N-[(Z)-(2,5-dimethylphenyl)methylideneamino]-4-(phenoxymethyl)benzamide?
N-[(Z)-(2,5-dimethylphenyl)methylideneamino]-4-(phenoxymethyl)benzamide has a molecular weight of 358.44 g/mol, XLogP of 4.65, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-(2,5-dimethylphenyl)methylideneamino]-4-(phenoxymethyl)benzamide is sourced from PubChem (CID 8518266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).