1-(2,4-dichlorophenyl)-N-(3,4-dimethoxyphenyl)methanimine

C15H13Cl2NO2 — CID 5070824

IUPAC1-(2,4-dichlorophenyl)-N-(3,4-dimethoxyphenyl)methanimine
SMILESCOc1ccc(/N=C/c2ccc(Cl)cc2Cl)cc1OC
InChIInChI=1S/C15H13Cl2NO2/c1-19-14-6-5-12(8-15(14)20-2)18-9-10-3-4-11(16)7-13(10)17/h3-9H,1-2H3/b18-9+
InChIKeyJVYKHXDWUXJRSL-GIJQJNRQSA-N
MW310.18 g/mol
LogP4.76
Rot. Bonds4

About 1-(2,4-dichlorophenyl)-N-(3,4-dimethoxyphenyl)methanimine

1-(2,4-dichlorophenyl)-N-(3,4-dimethoxyphenyl)methanimine (PubChem CID 5070824) has the molecular formula C15H13Cl2NO2 and a molecular weight of 310.18 g/mol. Its IUPAC name is 1-(2,4-dichlorophenyl)-N-(3,4-dimethoxyphenyl)methanimine.

Molecular Properties

Compound Name1-(2,4-dichlorophenyl)-N-(3,4-dimethoxyphenyl)methanimine
PubChem CID5070824
Molecular FormulaC15H13Cl2NO2
Molecular Weight310.18 g/mol
Exact Mass309.03
IUPAC Name1-(2,4-dichlorophenyl)-N-(3,4-dimethoxyphenyl)methanimine
SMILESCOc1ccc(/N=C/c2ccc(Cl)cc2Cl)cc1OC
InChIInChI=1S/C15H13Cl2NO2/c1-19-14-6-5-12(8-15(14)20-2)18-9-10-3-4-11(16)7-13(10)17/h3-9H,1-2H3/b18-9+
InChIKeyJVYKHXDWUXJRSL-GIJQJNRQSA-N
XLogP4.76
TPSA30.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.18
LogP ≤ 54.76
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

1-(2,4-dichlorophenyl)-N-(3,4,5-trimethoxyphenyl)methanimine
CID 3899999
1-(2,4-dichlorophenyl)-N-(3,4-dichlorophenyl)methanimine
CID 3629789
1-(5-chloro-2-methoxyphenyl)-N-(3-chloro-4-methylphenyl)methanimine
CID 833856
1-(2,4-dichlorophenyl)-N-(2-methoxy-5-nitrophenyl)methanimine
CID 3520188
N-[(E)-(2,4-dichlorophenyl)methylideneamino]-3,4-dimethoxybenzamide
CID 6910490
1-[(2,4-dichlorophenyl)methylideneamino]-3-(3,4-dimethoxyphenyl)thiourea
CID 3676997
1-(2,4-dichlorophenyl)-N-[4-[4-[(2,4-dichlorophenyl)methylideneamino]phenyl]sulfonylphenyl]methanimine
CID 3091569
2-[(3-chloro-4-methoxyphenyl)iminomethyl]phenol
CID 964874
1-(2-bromo-4,5-dimethoxyphenyl)-N-[4-[(2-bromo-4,5-dimethoxyphenyl)methylideneamino]phenyl]methanimine
CID 101215350
N-[5-[(2,4-dichlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl]-1-(2,4-dichlorophenyl)methanimine
CID 23966794
1-(4-chloro-3-nitrophenyl)-N-(3,4-dimethoxyphenyl)methanimine
CID 758987
N-(1-tert-butylbenzimidazol-5-yl)-1-(2,4-dichlorophenyl)methanimine
CID 2311626

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dichlorophenyl)-N-(3,4-dimethoxyphenyl)methanimine?
The IUPAC name of 1-(2,4-dichlorophenyl)-N-(3,4-dimethoxyphenyl)methanimine (CID 5070824) is 1-(2,4-dichlorophenyl)-N-(3,4-dimethoxyphenyl)methanimine.
What is the SMILES notation for 1-(2,4-dichlorophenyl)-N-(3,4-dimethoxyphenyl)methanimine?
The canonical SMILES for 1-(2,4-dichlorophenyl)-N-(3,4-dimethoxyphenyl)methanimine is COc1ccc(/N=C/c2ccc(Cl)cc2Cl)cc1OC.
What is the InChIKey of 1-(2,4-dichlorophenyl)-N-(3,4-dimethoxyphenyl)methanimine?
The InChIKey is JVYKHXDWUXJRSL-GIJQJNRQSA-N. The full InChI is InChI=1S/C15H13Cl2NO2/c1-19-14-6-5-12(8-15(14)20-2)18-9-10-3-4-11(16)7-13(10)17/h3-9H,1-2H3/b18-9+.
What are the key properties of 1-(2,4-dichlorophenyl)-N-(3,4-dimethoxyphenyl)methanimine?
1-(2,4-dichlorophenyl)-N-(3,4-dimethoxyphenyl)methanimine has a molecular weight of 310.18 g/mol, XLogP of 4.76, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dichlorophenyl)-N-(3,4-dimethoxyphenyl)methanimine is sourced from PubChem (CID 5070824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).