N-naphthalen-1-yl-1-(2-phenylmethoxyphenyl)methanimine

C24H19NO — CID 4644937

IUPACN-naphthalen-1-yl-1-(2-phenylmethoxyphenyl)methanimine
SMILESC(=N/c1cccc2ccccc12)\c1ccccc1OCc1ccccc1
InChIInChI=1S/C24H19NO/c1-2-9-19(10-3-1)18-26-24-16-7-5-12-21(24)17-25-23-15-8-13-20-11-4-6-14-22(20)23/h1-17H,18H2/b25-17+
InChIKeyNZUOBLGOAPUBNH-KOEQRZSOSA-N
MW337.42 g/mol
LogP6.17
Rot. Bonds5

About N-naphthalen-1-yl-1-(2-phenylmethoxyphenyl)methanimine

N-naphthalen-1-yl-1-(2-phenylmethoxyphenyl)methanimine (PubChem CID 4644937) has the molecular formula C24H19NO and a molecular weight of 337.42 g/mol. Its IUPAC name is N-naphthalen-1-yl-1-(2-phenylmethoxyphenyl)methanimine.

Molecular Properties

Compound NameN-naphthalen-1-yl-1-(2-phenylmethoxyphenyl)methanimine
PubChem CID4644937
Molecular FormulaC24H19NO
Molecular Weight337.42 g/mol
Exact Mass337.15
IUPAC NameN-naphthalen-1-yl-1-(2-phenylmethoxyphenyl)methanimine
SMILESC(=N/c1cccc2ccccc12)\c1ccccc1OCc1ccccc1
InChIInChI=1S/C24H19NO/c1-2-9-19(10-3-1)18-26-24-16-7-5-12-21(24)17-25-23-15-8-13-20-11-4-6-14-22(20)23/h1-17H,18H2/b25-17+
InChIKeyNZUOBLGOAPUBNH-KOEQRZSOSA-N
XLogP6.17
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500337.42
LogP ≤ 56.17
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-naphthalen-1-yl-1-(2-phenylmethoxyphenyl)methanimine?
The IUPAC name of N-naphthalen-1-yl-1-(2-phenylmethoxyphenyl)methanimine (CID 4644937) is N-naphthalen-1-yl-1-(2-phenylmethoxyphenyl)methanimine.
What is the SMILES notation for N-naphthalen-1-yl-1-(2-phenylmethoxyphenyl)methanimine?
The canonical SMILES for N-naphthalen-1-yl-1-(2-phenylmethoxyphenyl)methanimine is C(=N/c1cccc2ccccc12)\c1ccccc1OCc1ccccc1.
What is the InChIKey of N-naphthalen-1-yl-1-(2-phenylmethoxyphenyl)methanimine?
The InChIKey is NZUOBLGOAPUBNH-KOEQRZSOSA-N. The full InChI is InChI=1S/C24H19NO/c1-2-9-19(10-3-1)18-26-24-16-7-5-12-21(24)17-25-23-15-8-13-20-11-4-6-14-22(20)23/h1-17H,18H2/b25-17+.
What are the key properties of N-naphthalen-1-yl-1-(2-phenylmethoxyphenyl)methanimine?
N-naphthalen-1-yl-1-(2-phenylmethoxyphenyl)methanimine has a molecular weight of 337.42 g/mol, XLogP of 6.17, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-1-yl-1-(2-phenylmethoxyphenyl)methanimine is sourced from PubChem (CID 4644937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).