N-naphthalen-2-yl-4-pyridin-2-ylbenzamide

C22H16N2O — CID 59673032

IUPACN-naphthalen-2-yl-4-pyridin-2-ylbenzamide
SMILESO=C(Nc1ccc2ccccc2c1)c1ccc(-c2ccccn2)cc1
InChIInChI=1S/C22H16N2O/c25-22(24-20-13-12-16-5-1-2-6-19(16)15-20)18-10-8-17(9-11-18)21-7-3-4-14-23-21/h1-15H,(H,24,25)
InChIKeyOREWCWXAWCIIRK-UHFFFAOYSA-N
MW324.38 g/mol
LogP5.15
Rot. Bonds3

About N-naphthalen-2-yl-4-pyridin-2-ylbenzamide

N-naphthalen-2-yl-4-pyridin-2-ylbenzamide (PubChem CID 59673032) has the molecular formula C22H16N2O and a molecular weight of 324.38 g/mol. Its IUPAC name is N-naphthalen-2-yl-4-pyridin-2-ylbenzamide.

Molecular Properties

Compound NameN-naphthalen-2-yl-4-pyridin-2-ylbenzamide
PubChem CID59673032
Molecular FormulaC22H16N2O
Molecular Weight324.38 g/mol
Exact Mass324.13
IUPAC NameN-naphthalen-2-yl-4-pyridin-2-ylbenzamide
SMILESO=C(Nc1ccc2ccccc2c1)c1ccc(-c2ccccn2)cc1
InChIInChI=1S/C22H16N2O/c25-22(24-20-13-12-16-5-1-2-6-19(16)15-20)18-10-8-17(9-11-18)21-7-3-4-14-23-21/h1-15H,(H,24,25)
InChIKeyOREWCWXAWCIIRK-UHFFFAOYSA-N
XLogP5.15
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.38
LogP ≤ 55.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-naphthalen-2-yl-4-pyridin-2-ylbenzamide?
The IUPAC name of N-naphthalen-2-yl-4-pyridin-2-ylbenzamide (CID 59673032) is N-naphthalen-2-yl-4-pyridin-2-ylbenzamide.
What is the SMILES notation for N-naphthalen-2-yl-4-pyridin-2-ylbenzamide?
The canonical SMILES for N-naphthalen-2-yl-4-pyridin-2-ylbenzamide is O=C(Nc1ccc2ccccc2c1)c1ccc(-c2ccccn2)cc1.
What is the InChIKey of N-naphthalen-2-yl-4-pyridin-2-ylbenzamide?
The InChIKey is OREWCWXAWCIIRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16N2O/c25-22(24-20-13-12-16-5-1-2-6-19(16)15-20)18-10-8-17(9-11-18)21-7-3-4-14-23-21/h1-15H,(H,24,25).
What are the key properties of N-naphthalen-2-yl-4-pyridin-2-ylbenzamide?
N-naphthalen-2-yl-4-pyridin-2-ylbenzamide has a molecular weight of 324.38 g/mol, XLogP of 5.15, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-2-yl-4-pyridin-2-ylbenzamide is sourced from PubChem (CID 59673032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).