N-(naphthalen-2-ylmethylidene)benzamide

C18H13NO — CID 101463832

IUPACN-(naphthalen-2-ylmethylidene)benzamide
SMILESO=C(/N=C/c1ccc2ccccc2c1)c1ccccc1
InChIInChI=1S/C18H13NO/c20-18(16-7-2-1-3-8-16)19-13-14-10-11-15-6-4-5-9-17(15)12-14/h1-13H/b19-13+
InChIKeyJEUYZSWLULFPJE-CPNJWEJPSA-N
MW259.31 g/mol
LogP4.10
Rot. Bonds2

About N-(naphthalen-2-ylmethylidene)benzamide

N-(naphthalen-2-ylmethylidene)benzamide (PubChem CID 101463832) has the molecular formula C18H13NO and a molecular weight of 259.31 g/mol. Its IUPAC name is N-(naphthalen-2-ylmethylidene)benzamide.

Molecular Properties

Compound NameN-(naphthalen-2-ylmethylidene)benzamide
PubChem CID101463832
Molecular FormulaC18H13NO
Molecular Weight259.31 g/mol
Exact Mass259.10
IUPAC NameN-(naphthalen-2-ylmethylidene)benzamide
SMILESO=C(/N=C/c1ccc2ccccc2c1)c1ccccc1
InChIInChI=1S/C18H13NO/c20-18(16-7-2-1-3-8-16)19-13-14-10-11-15-6-4-5-9-17(15)12-14/h1-13H/b19-13+
InChIKeyJEUYZSWLULFPJE-CPNJWEJPSA-N
XLogP4.10
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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-2-ylmethylidene)benzamide?
The IUPAC name of N-(naphthalen-2-ylmethylidene)benzamide (CID 101463832) is N-(naphthalen-2-ylmethylidene)benzamide.
What is the SMILES notation for N-(naphthalen-2-ylmethylidene)benzamide?
The canonical SMILES for N-(naphthalen-2-ylmethylidene)benzamide is O=C(/N=C/c1ccc2ccccc2c1)c1ccccc1.
What is the InChIKey of N-(naphthalen-2-ylmethylidene)benzamide?
The InChIKey is JEUYZSWLULFPJE-CPNJWEJPSA-N. The full InChI is InChI=1S/C18H13NO/c20-18(16-7-2-1-3-8-16)19-13-14-10-11-15-6-4-5-9-17(15)12-14/h1-13H/b19-13+.
What are the key properties of N-(naphthalen-2-ylmethylidene)benzamide?
N-(naphthalen-2-ylmethylidene)benzamide has a molecular weight of 259.31 g/mol, XLogP of 4.10, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(naphthalen-2-ylmethylidene)benzamide is sourced from PubChem (CID 101463832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).