N-(2,3-dimethylphenyl)-1-(3-methoxy-4-phenylmethoxyphenyl)methanimine

C23H23NO2 — CID 126218926

IUPACN-(2,3-dimethylphenyl)-1-(3-methoxy-4-phenylmethoxyphenyl)methanimine
SMILESCOc1cc(/C=N/c2cccc(C)c2C)ccc1OCc1ccccc1
InChIInChI=1S/C23H23NO2/c1-17-8-7-11-21(18(17)2)24-15-20-12-13-22(23(14-20)25-3)26-16-19-9-5-4-6-10-19/h4-15H,16H2,1-3H3/b24-15+
InChIKeyPXISHWVHXPNPEA-BUVRLJJBSA-N
MW345.44 g/mol
LogP5.64
Rot. Bonds6

About N-(2,3-dimethylphenyl)-1-(3-methoxy-4-phenylmethoxyphenyl)methanimine

N-(2,3-dimethylphenyl)-1-(3-methoxy-4-phenylmethoxyphenyl)methanimine (PubChem CID 126218926) has the molecular formula C23H23NO2 and a molecular weight of 345.44 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-1-(3-methoxy-4-phenylmethoxyphenyl)methanimine.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-1-(3-methoxy-4-phenylmethoxyphenyl)methanimine
PubChem CID126218926
Molecular FormulaC23H23NO2
Molecular Weight345.44 g/mol
Exact Mass345.17
IUPAC NameN-(2,3-dimethylphenyl)-1-(3-methoxy-4-phenylmethoxyphenyl)methanimine
SMILESCOc1cc(/C=N/c2cccc(C)c2C)ccc1OCc1ccccc1
InChIInChI=1S/C23H23NO2/c1-17-8-7-11-21(18(17)2)24-15-20-12-13-22(23(14-20)25-3)26-16-19-9-5-4-6-10-19/h4-15H,16H2,1-3H3/b24-15+
InChIKeyPXISHWVHXPNPEA-BUVRLJJBSA-N
XLogP5.64
TPSA30.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500345.44
LogP ≤ 55.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2,3-dimethylphenyl)-1-[4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl]methanimine
CID 126207011
1-(3-chloro-5-methoxy-4-phenylmethoxyphenyl)-N-(2,3-dimethylphenyl)methanimine
CID 126222406
1-(3,5-dichloro-4-phenylmethoxyphenyl)-N-(2,3-dimethylphenyl)methanimine
CID 126209246
N-[(E)-(3-methoxy-4-phenylmethoxyphenyl)methylideneamino]-N-methylmethanamine
CID 96885458
1-(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)-N-(2,3-dimethylphenyl)methanimine
CID 126214078
1-(3-bromo-5-methoxy-4-phenylmethoxyphenyl)-N-(2-methylphenyl)methanimine
CID 126224885
3-methoxy-4-phenylmethoxybenzaldehyde
CID 161042191
N-(3-chloro-2-methylphenyl)-1-(3-iodo-5-methoxy-4-phenylmethoxyphenyl)methanimine
CID 126221318
4-[[2-methoxy-4-[(2-methylsulfanylphenyl)iminomethyl]phenoxy]methyl]benzoic acid
CID 23763275
[4-[(2,3-dimethylphenyl)iminomethyl]-2-methoxyphenyl] 4-methylbenzenesulfonate
CID 126221701
2-(2,6-dimethylanilino)-N-[(3-methoxy-4-phenylmethoxyphenyl)methylideneamino]acetamide
CID 3726528
1-[3-chloro-4-[(2-fluorophenyl)methoxy]phenyl]-N-(2,3-dimethylphenyl)methanimine
CID 126206108

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-1-(3-methoxy-4-phenylmethoxyphenyl)methanimine?
The IUPAC name of N-(2,3-dimethylphenyl)-1-(3-methoxy-4-phenylmethoxyphenyl)methanimine (CID 126218926) is N-(2,3-dimethylphenyl)-1-(3-methoxy-4-phenylmethoxyphenyl)methanimine.
What is the SMILES notation for N-(2,3-dimethylphenyl)-1-(3-methoxy-4-phenylmethoxyphenyl)methanimine?
The canonical SMILES for N-(2,3-dimethylphenyl)-1-(3-methoxy-4-phenylmethoxyphenyl)methanimine is COc1cc(/C=N/c2cccc(C)c2C)ccc1OCc1ccccc1.
What is the InChIKey of N-(2,3-dimethylphenyl)-1-(3-methoxy-4-phenylmethoxyphenyl)methanimine?
The InChIKey is PXISHWVHXPNPEA-BUVRLJJBSA-N. The full InChI is InChI=1S/C23H23NO2/c1-17-8-7-11-21(18(17)2)24-15-20-12-13-22(23(14-20)25-3)26-16-19-9-5-4-6-10-19/h4-15H,16H2,1-3H3/b24-15+.
What are the key properties of N-(2,3-dimethylphenyl)-1-(3-methoxy-4-phenylmethoxyphenyl)methanimine?
N-(2,3-dimethylphenyl)-1-(3-methoxy-4-phenylmethoxyphenyl)methanimine has a molecular weight of 345.44 g/mol, XLogP of 5.64, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)-1-(3-methoxy-4-phenylmethoxyphenyl)methanimine is sourced from PubChem (CID 126218926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).