1-(3-methoxyphenyl)-N-[2-[(3-methoxyphenyl)methylideneamino]phenyl]methanimine

C22H20N2O2 — CID 932000

IUPAC1-(3-methoxyphenyl)-N-[2-[(3-methoxyphenyl)methylideneamino]phenyl]methanimine
SMILESCOc1cccc(/C=N/c2ccccc2/N=C/c2cccc(OC)c2)c1
InChIInChI=1S/C22H20N2O2/c1-25-19-9-5-7-17(13-19)15-23-21-11-3-4-12-22(21)24-16-18-8-6-10-20(14-18)26-2/h3-16H,1-2H3/b23-15+,24-16+
InChIKeySKDJZJJEGSQWLB-DFEHQXHXSA-N
MW344.41 g/mol
LogP5.20
Rot. Bonds6

About 1-(3-methoxyphenyl)-N-[2-[(3-methoxyphenyl)methylideneamino]phenyl]methanimine

1-(3-methoxyphenyl)-N-[2-[(3-methoxyphenyl)methylideneamino]phenyl]methanimine (PubChem CID 932000) has the molecular formula C22H20N2O2 and a molecular weight of 344.41 g/mol. Its IUPAC name is 1-(3-methoxyphenyl)-N-[2-[(3-methoxyphenyl)methylideneamino]phenyl]methanimine.

Molecular Properties

Compound Name1-(3-methoxyphenyl)-N-[2-[(3-methoxyphenyl)methylideneamino]phenyl]methanimine
PubChem CID932000
Molecular FormulaC22H20N2O2
Molecular Weight344.41 g/mol
Exact Mass344.15
IUPAC Name1-(3-methoxyphenyl)-N-[2-[(3-methoxyphenyl)methylideneamino]phenyl]methanimine
SMILESCOc1cccc(/C=N/c2ccccc2/N=C/c2cccc(OC)c2)c1
InChIInChI=1S/C22H20N2O2/c1-25-19-9-5-7-17(13-19)15-23-21-11-3-4-12-22(21)24-16-18-8-6-10-20(14-18)26-2/h3-16H,1-2H3/b23-15+,24-16+
InChIKeySKDJZJJEGSQWLB-DFEHQXHXSA-N
XLogP5.20
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.41
LogP ≤ 55.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

5-bromo-2-[(3-methoxyphenyl)methylideneamino]phenol
CID 142246969
N-(3,5-dichlorophenyl)-1-(3-methoxyphenyl)methanimine
CID 932077
1-(3-methoxyphenyl)-N-propan-2-ylmethanimine
CID 23423541
N-[(E)-(3-methoxyphenyl)methylideneamino]methanamine
CID 110339403
N-(4-ethylphenyl)-1-(3-methoxyphenyl)methanimine
CID 126208711
N-(3-methoxyphenyl)-1-(3-methylphenyl)methanimine
CID 86728778
1-(3-ethoxyphenyl)-N-(2-methylphenyl)methanimine
CID 126208870
1-(3-methoxyphenyl)-N-methylmethanimine oxide
CID 4702337
N-[(3-methoxyphenyl)methylideneamino]-N-methylaniline
CID 3291693
1-(3-ethoxyphenyl)-N-(4-methoxyphenyl)methanimine
CID 126205496
1,3-bis[(Z)-(3-methoxyphenyl)methylideneamino]urea
CID 5414266
iron(3+);5-methoxy-2-[[2-[(4-methoxy-2-oxidophenyl)methylideneamino]phenyl]iminomethyl]phenolate;chloride
CID 50908685

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxyphenyl)-N-[2-[(3-methoxyphenyl)methylideneamino]phenyl]methanimine?
The IUPAC name of 1-(3-methoxyphenyl)-N-[2-[(3-methoxyphenyl)methylideneamino]phenyl]methanimine (CID 932000) is 1-(3-methoxyphenyl)-N-[2-[(3-methoxyphenyl)methylideneamino]phenyl]methanimine.
What is the SMILES notation for 1-(3-methoxyphenyl)-N-[2-[(3-methoxyphenyl)methylideneamino]phenyl]methanimine?
The canonical SMILES for 1-(3-methoxyphenyl)-N-[2-[(3-methoxyphenyl)methylideneamino]phenyl]methanimine is COc1cccc(/C=N/c2ccccc2/N=C/c2cccc(OC)c2)c1.
What is the InChIKey of 1-(3-methoxyphenyl)-N-[2-[(3-methoxyphenyl)methylideneamino]phenyl]methanimine?
The InChIKey is SKDJZJJEGSQWLB-DFEHQXHXSA-N. The full InChI is InChI=1S/C22H20N2O2/c1-25-19-9-5-7-17(13-19)15-23-21-11-3-4-12-22(21)24-16-18-8-6-10-20(14-18)26-2/h3-16H,1-2H3/b23-15+,24-16+.
What are the key properties of 1-(3-methoxyphenyl)-N-[2-[(3-methoxyphenyl)methylideneamino]phenyl]methanimine?
1-(3-methoxyphenyl)-N-[2-[(3-methoxyphenyl)methylideneamino]phenyl]methanimine has a molecular weight of 344.41 g/mol, XLogP of 5.20, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxyphenyl)-N-[2-[(3-methoxyphenyl)methylideneamino]phenyl]methanimine is sourced from PubChem (CID 932000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).