N-benzyl-1-(4-methoxyphenyl)methanimine

C15H15NO — CID 525701

IUPACN-benzyl-1-(4-methoxyphenyl)methanimine
SMILESCOc1ccc(/C=N/Cc2ccccc2)cc1
InChIInChI=1S/C15H15NO/c1-17-15-9-7-14(8-10-15)12-16-11-13-5-3-2-4-6-13/h2-10,12H,11H2,1H3/b16-12+
InChIKeyJVVLETNWSMVHLM-FOWTUZBSSA-N
MW225.29 g/mol
LogP3.31
Rot. Bonds4

About N-benzyl-1-(4-methoxyphenyl)methanimine

N-benzyl-1-(4-methoxyphenyl)methanimine (PubChem CID 525701) has the molecular formula C15H15NO and a molecular weight of 225.29 g/mol. Its IUPAC name is N-benzyl-1-(4-methoxyphenyl)methanimine.

Molecular Properties

Compound NameN-benzyl-1-(4-methoxyphenyl)methanimine
PubChem CID525701
Molecular FormulaC15H15NO
Molecular Weight225.29 g/mol
Exact Mass225.12
IUPAC NameN-benzyl-1-(4-methoxyphenyl)methanimine
SMILESCOc1ccc(/C=N/Cc2ccccc2)cc1
InChIInChI=1S/C15H15NO/c1-17-15-9-7-14(8-10-15)12-16-11-13-5-3-2-4-6-13/h2-10,12H,11H2,1H3/b16-12+
InChIKeyJVVLETNWSMVHLM-FOWTUZBSSA-N
XLogP3.31
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 N-benzyl-1-(4-methoxyphenyl)methanimine?
The IUPAC name of N-benzyl-1-(4-methoxyphenyl)methanimine (CID 525701) is N-benzyl-1-(4-methoxyphenyl)methanimine.
What is the SMILES notation for N-benzyl-1-(4-methoxyphenyl)methanimine?
The canonical SMILES for N-benzyl-1-(4-methoxyphenyl)methanimine is COc1ccc(/C=N/Cc2ccccc2)cc1.
What is the InChIKey of N-benzyl-1-(4-methoxyphenyl)methanimine?
The InChIKey is JVVLETNWSMVHLM-FOWTUZBSSA-N. The full InChI is InChI=1S/C15H15NO/c1-17-15-9-7-14(8-10-15)12-16-11-13-5-3-2-4-6-13/h2-10,12H,11H2,1H3/b16-12+.
What are the key properties of N-benzyl-1-(4-methoxyphenyl)methanimine?
N-benzyl-1-(4-methoxyphenyl)methanimine has a molecular weight of 225.29 g/mol, XLogP of 3.31, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-1-(4-methoxyphenyl)methanimine is sourced from PubChem (CID 525701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).