2-methoxy-4-[(4-methoxyphenyl)iminomethyl]phenol

C15H15NO3 — CID 681370

IUPAC2-methoxy-4-[(4-methoxyphenyl)iminomethyl]phenol
SMILESCOc1ccc(/N=C/c2ccc(O)c(OC)c2)cc1
InChIInChI=1S/C15H15NO3/c1-18-13-6-4-12(5-7-13)16-10-11-3-8-14(17)15(9-11)19-2/h3-10,17H,1-2H3/b16-10+
InChIKeyKDIGZGCAYQKYEH-MHWRWJLKSA-N
MW257.29 g/mol
LogP3.16
Rot. Bonds4

About 2-methoxy-4-[(4-methoxyphenyl)iminomethyl]phenol

2-methoxy-4-[(4-methoxyphenyl)iminomethyl]phenol (PubChem CID 681370) has the molecular formula C15H15NO3 and a molecular weight of 257.29 g/mol. Its IUPAC name is 2-methoxy-4-[(4-methoxyphenyl)iminomethyl]phenol.

Molecular Properties

Compound Name2-methoxy-4-[(4-methoxyphenyl)iminomethyl]phenol
PubChem CID681370
Molecular FormulaC15H15NO3
Molecular Weight257.29 g/mol
Exact Mass257.11
IUPAC Name2-methoxy-4-[(4-methoxyphenyl)iminomethyl]phenol
SMILESCOc1ccc(/N=C/c2ccc(O)c(OC)c2)cc1
InChIInChI=1S/C15H15NO3/c1-18-13-6-4-12(5-7-13)16-10-11-3-8-14(17)15(9-11)19-2/h3-10,17H,1-2H3/b16-10+
InChIKeyKDIGZGCAYQKYEH-MHWRWJLKSA-N
XLogP3.16
TPSA51.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4-[(4-methoxyphenyl)iminomethyl]phenol?
The IUPAC name of 2-methoxy-4-[(4-methoxyphenyl)iminomethyl]phenol (CID 681370) is 2-methoxy-4-[(4-methoxyphenyl)iminomethyl]phenol.
What is the SMILES notation for 2-methoxy-4-[(4-methoxyphenyl)iminomethyl]phenol?
The canonical SMILES for 2-methoxy-4-[(4-methoxyphenyl)iminomethyl]phenol is COc1ccc(/N=C/c2ccc(O)c(OC)c2)cc1.
What is the InChIKey of 2-methoxy-4-[(4-methoxyphenyl)iminomethyl]phenol?
The InChIKey is KDIGZGCAYQKYEH-MHWRWJLKSA-N. The full InChI is InChI=1S/C15H15NO3/c1-18-13-6-4-12(5-7-13)16-10-11-3-8-14(17)15(9-11)19-2/h3-10,17H,1-2H3/b16-10+.
What are the key properties of 2-methoxy-4-[(4-methoxyphenyl)iminomethyl]phenol?
2-methoxy-4-[(4-methoxyphenyl)iminomethyl]phenol has a molecular weight of 257.29 g/mol, XLogP of 3.16, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-[(4-methoxyphenyl)iminomethyl]phenol is sourced from PubChem (CID 681370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).