1-(2-methoxynaphthalen-1-yl)-N-(4-methoxyphenyl)methanimine

C19H17NO2 — CID 693450

IUPAC1-(2-methoxynaphthalen-1-yl)-N-(4-methoxyphenyl)methanimine
SMILESCOc1ccc(/N=C/c2c(OC)ccc3ccccc23)cc1
InChIInChI=1S/C19H17NO2/c1-21-16-10-8-15(9-11-16)20-13-18-17-6-4-3-5-14(17)7-12-19(18)22-2/h3-13H,1-2H3/b20-13+
InChIKeySDFYPIJTLCZAIF-DEDYPNTBSA-N
MW291.35 g/mol
LogP4.61
Rot. Bonds4

About 1-(2-methoxynaphthalen-1-yl)-N-(4-methoxyphenyl)methanimine

1-(2-methoxynaphthalen-1-yl)-N-(4-methoxyphenyl)methanimine (PubChem CID 693450) has the molecular formula C19H17NO2 and a molecular weight of 291.35 g/mol. Its IUPAC name is 1-(2-methoxynaphthalen-1-yl)-N-(4-methoxyphenyl)methanimine.

Molecular Properties

Compound Name1-(2-methoxynaphthalen-1-yl)-N-(4-methoxyphenyl)methanimine
PubChem CID693450
Molecular FormulaC19H17NO2
Molecular Weight291.35 g/mol
Exact Mass291.13
IUPAC Name1-(2-methoxynaphthalen-1-yl)-N-(4-methoxyphenyl)methanimine
SMILESCOc1ccc(/N=C/c2c(OC)ccc3ccccc23)cc1
InChIInChI=1S/C19H17NO2/c1-21-16-10-8-15(9-11-16)20-13-18-17-6-4-3-5-14(17)7-12-19(18)22-2/h3-13H,1-2H3/b20-13+
InChIKeySDFYPIJTLCZAIF-DEDYPNTBSA-N
XLogP4.61
TPSA30.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 1-(2-methoxynaphthalen-1-yl)-N-(4-methoxyphenyl)methanimine?
The IUPAC name of 1-(2-methoxynaphthalen-1-yl)-N-(4-methoxyphenyl)methanimine (CID 693450) is 1-(2-methoxynaphthalen-1-yl)-N-(4-methoxyphenyl)methanimine.
What is the SMILES notation for 1-(2-methoxynaphthalen-1-yl)-N-(4-methoxyphenyl)methanimine?
The canonical SMILES for 1-(2-methoxynaphthalen-1-yl)-N-(4-methoxyphenyl)methanimine is COc1ccc(/N=C/c2c(OC)ccc3ccccc23)cc1.
What is the InChIKey of 1-(2-methoxynaphthalen-1-yl)-N-(4-methoxyphenyl)methanimine?
The InChIKey is SDFYPIJTLCZAIF-DEDYPNTBSA-N. The full InChI is InChI=1S/C19H17NO2/c1-21-16-10-8-15(9-11-16)20-13-18-17-6-4-3-5-14(17)7-12-19(18)22-2/h3-13H,1-2H3/b20-13+.
What are the key properties of 1-(2-methoxynaphthalen-1-yl)-N-(4-methoxyphenyl)methanimine?
1-(2-methoxynaphthalen-1-yl)-N-(4-methoxyphenyl)methanimine has a molecular weight of 291.35 g/mol, XLogP of 4.61, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxynaphthalen-1-yl)-N-(4-methoxyphenyl)methanimine is sourced from PubChem (CID 693450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).