1-[3-[(4-methoxyphenyl)iminomethyl]phenyl]-N-[(4-methoxyphenyl)methyl]methanimine

C23H22N2O2 — CID 160577318

IUPAC1-[3-[(4-methoxyphenyl)iminomethyl]phenyl]-N-[(4-methoxyphenyl)methyl]methanimine
SMILESCOc1ccc(C/N=C/c2cccc(/C=N/c3ccc(OC)cc3)c2)cc1
InChIInChI=1S/C23H22N2O2/c1-26-22-10-6-18(7-11-22)15-24-16-19-4-3-5-20(14-19)17-25-21-8-12-23(27-2)13-9-21/h3-14,16-17H,15H2,1-2H3/b24-16+,25-17+
InChIKeyRBHZKXIXDFAXCO-MUPYBJATSA-N
MW358.44 g/mol
LogP5.07
Rot. Bonds7

About 1-[3-[(4-methoxyphenyl)iminomethyl]phenyl]-N-[(4-methoxyphenyl)methyl]methanimine

1-[3-[(4-methoxyphenyl)iminomethyl]phenyl]-N-[(4-methoxyphenyl)methyl]methanimine (PubChem CID 160577318) has the molecular formula C23H22N2O2 and a molecular weight of 358.44 g/mol. Its IUPAC name is 1-[3-[(4-methoxyphenyl)iminomethyl]phenyl]-N-[(4-methoxyphenyl)methyl]methanimine.

Molecular Properties

Compound Name1-[3-[(4-methoxyphenyl)iminomethyl]phenyl]-N-[(4-methoxyphenyl)methyl]methanimine
PubChem CID160577318
Molecular FormulaC23H22N2O2
Molecular Weight358.44 g/mol
Exact Mass358.17
IUPAC Name1-[3-[(4-methoxyphenyl)iminomethyl]phenyl]-N-[(4-methoxyphenyl)methyl]methanimine
SMILESCOc1ccc(C/N=C/c2cccc(/C=N/c3ccc(OC)cc3)c2)cc1
InChIInChI=1S/C23H22N2O2/c1-26-22-10-6-18(7-11-22)15-24-16-19-4-3-5-20(14-19)17-25-21-8-12-23(27-2)13-9-21/h3-14,16-17H,15H2,1-2H3/b24-16+,25-17+
InChIKeyRBHZKXIXDFAXCO-MUPYBJATSA-N
XLogP5.07
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.44
LogP ≤ 55.07
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

N-(4-ethylphenyl)-1-(3-methoxyphenyl)methanimine
CID 126208711
1-(3-ethoxyphenyl)-N-(4-methoxyphenyl)methanimine
CID 126205496
1-(4-methoxyphenyl)-N-[3-[(4-methoxyphenyl)methylideneamino]phenyl]methanimine
CID 18527961
1-[4-[(4-bromophenyl)methoxy]-3-methoxyphenyl]-N-(4-methoxyphenyl)methanimine
CID 126218213
1-(3-ethoxyphenyl)-N-(4-ethylphenyl)methanimine
CID 126216277
1-[4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]-N-(4-methoxyphenyl)methanimine
CID 1018502
1-(2,6-dichlorophenyl)-N-(4-methoxyphenyl)methanimine
CID 927293
2,4-dichloro-6-[(4-methoxyphenyl)methyliminomethyl]phenol
CID 2806894
N-(3-methoxyphenyl)-1-(3-methylphenyl)methanimine
CID 86728778
N-(3,5-dichlorophenyl)-1-(3-methoxyphenyl)methanimine
CID 932077
1-(4-methoxyphenyl)-N-(4-propoxyphenyl)methanimine
CID 71354195
4-[(4-methoxyphenyl)methylideneamino]-N,N-dimethylaniline
CID 3748752

Frequently Asked Questions

What is the IUPAC name of 1-[3-[(4-methoxyphenyl)iminomethyl]phenyl]-N-[(4-methoxyphenyl)methyl]methanimine?
The IUPAC name of 1-[3-[(4-methoxyphenyl)iminomethyl]phenyl]-N-[(4-methoxyphenyl)methyl]methanimine (CID 160577318) is 1-[3-[(4-methoxyphenyl)iminomethyl]phenyl]-N-[(4-methoxyphenyl)methyl]methanimine.
What is the SMILES notation for 1-[3-[(4-methoxyphenyl)iminomethyl]phenyl]-N-[(4-methoxyphenyl)methyl]methanimine?
The canonical SMILES for 1-[3-[(4-methoxyphenyl)iminomethyl]phenyl]-N-[(4-methoxyphenyl)methyl]methanimine is COc1ccc(C/N=C/c2cccc(/C=N/c3ccc(OC)cc3)c2)cc1.
What is the InChIKey of 1-[3-[(4-methoxyphenyl)iminomethyl]phenyl]-N-[(4-methoxyphenyl)methyl]methanimine?
The InChIKey is RBHZKXIXDFAXCO-MUPYBJATSA-N. The full InChI is InChI=1S/C23H22N2O2/c1-26-22-10-6-18(7-11-22)15-24-16-19-4-3-5-20(14-19)17-25-21-8-12-23(27-2)13-9-21/h3-14,16-17H,15H2,1-2H3/b24-16+,25-17+.
What are the key properties of 1-[3-[(4-methoxyphenyl)iminomethyl]phenyl]-N-[(4-methoxyphenyl)methyl]methanimine?
1-[3-[(4-methoxyphenyl)iminomethyl]phenyl]-N-[(4-methoxyphenyl)methyl]methanimine has a molecular weight of 358.44 g/mol, XLogP of 5.07, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[(4-methoxyphenyl)iminomethyl]phenyl]-N-[(4-methoxyphenyl)methyl]methanimine is sourced from PubChem (CID 160577318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).