2-[7-(2-formylphenyl)-1,8-naphthyridin-2-yl]benzaldehyde

C22H14N2O2 — CID 156790373

IUPAC2-[7-(2-formylphenyl)-1,8-naphthyridin-2-yl]benzaldehyde
SMILESO=Cc1ccccc1-c1ccc2ccc(-c3ccccc3C=O)nc2n1
InChIInChI=1S/C22H14N2O2/c25-13-16-5-1-3-7-18(16)20-11-9-15-10-12-21(24-22(15)23-20)19-8-4-2-6-17(19)14-26/h1-14H
InChIKeySZVSAFNQFQGNQX-UHFFFAOYSA-N
MW338.37 g/mol
LogP4.59
Rot. Bonds4

About 2-[7-(2-formylphenyl)-1,8-naphthyridin-2-yl]benzaldehyde

2-[7-(2-formylphenyl)-1,8-naphthyridin-2-yl]benzaldehyde (PubChem CID 156790373) has the molecular formula C22H14N2O2 and a molecular weight of 338.37 g/mol. Its IUPAC name is 2-[7-(2-formylphenyl)-1,8-naphthyridin-2-yl]benzaldehyde.

Molecular Properties

Compound Name2-[7-(2-formylphenyl)-1,8-naphthyridin-2-yl]benzaldehyde
PubChem CID156790373
Molecular FormulaC22H14N2O2
Molecular Weight338.37 g/mol
Exact Mass338.11
IUPAC Name2-[7-(2-formylphenyl)-1,8-naphthyridin-2-yl]benzaldehyde
SMILESO=Cc1ccccc1-c1ccc2ccc(-c3ccccc3C=O)nc2n1
InChIInChI=1S/C22H14N2O2/c25-13-16-5-1-3-7-18(16)20-11-9-15-10-12-21(24-22(15)23-20)19-8-4-2-6-17(19)14-26/h1-14H
InChIKeySZVSAFNQFQGNQX-UHFFFAOYSA-N
XLogP4.59
TPSA59.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.37
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[7-(2-formylphenyl)-1,8-naphthyridin-2-yl]benzaldehyde?
The IUPAC name of 2-[7-(2-formylphenyl)-1,8-naphthyridin-2-yl]benzaldehyde (CID 156790373) is 2-[7-(2-formylphenyl)-1,8-naphthyridin-2-yl]benzaldehyde.
What is the SMILES notation for 2-[7-(2-formylphenyl)-1,8-naphthyridin-2-yl]benzaldehyde?
The canonical SMILES for 2-[7-(2-formylphenyl)-1,8-naphthyridin-2-yl]benzaldehyde is O=Cc1ccccc1-c1ccc2ccc(-c3ccccc3C=O)nc2n1.
What is the InChIKey of 2-[7-(2-formylphenyl)-1,8-naphthyridin-2-yl]benzaldehyde?
The InChIKey is SZVSAFNQFQGNQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H14N2O2/c25-13-16-5-1-3-7-18(16)20-11-9-15-10-12-21(24-22(15)23-20)19-8-4-2-6-17(19)14-26/h1-14H.
What are the key properties of 2-[7-(2-formylphenyl)-1,8-naphthyridin-2-yl]benzaldehyde?
2-[7-(2-formylphenyl)-1,8-naphthyridin-2-yl]benzaldehyde has a molecular weight of 338.37 g/mol, XLogP of 4.59, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[7-(2-formylphenyl)-1,8-naphthyridin-2-yl]benzaldehyde is sourced from PubChem (CID 156790373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).