1-[(4-imidazo[1,2-a]pyridin-2-ylphenyl)iminomethyl]naphthalen-2-ol

C24H17N3O — CID 135734215

IUPAC1-[(4-imidazo[1,2-a]pyridin-2-ylphenyl)iminomethyl]naphthalen-2-ol
SMILESOc1ccc2ccccc2c1/C=N/c1ccc(-c2cn3ccccc3n2)cc1
InChIInChI=1S/C24H17N3O/c28-23-13-10-17-5-1-2-6-20(17)21(23)15-25-19-11-8-18(9-12-19)22-16-27-14-4-3-7-24(27)26-22/h1-16,28H/b25-15+
InChIKeyQCNGURAQQCHBDL-MFKUBSTISA-N
MW363.42 g/mol
LogP5.61
Rot. Bonds3

About 1-[(4-imidazo[1,2-a]pyridin-2-ylphenyl)iminomethyl]naphthalen-2-ol

1-[(4-imidazo[1,2-a]pyridin-2-ylphenyl)iminomethyl]naphthalen-2-ol (PubChem CID 135734215) has the molecular formula C24H17N3O and a molecular weight of 363.42 g/mol. Its IUPAC name is 1-[(4-imidazo[1,2-a]pyridin-2-ylphenyl)iminomethyl]naphthalen-2-ol.

Molecular Properties

Compound Name1-[(4-imidazo[1,2-a]pyridin-2-ylphenyl)iminomethyl]naphthalen-2-ol
PubChem CID135734215
Molecular FormulaC24H17N3O
Molecular Weight363.42 g/mol
Exact Mass363.14
IUPAC Name1-[(4-imidazo[1,2-a]pyridin-2-ylphenyl)iminomethyl]naphthalen-2-ol
SMILESOc1ccc2ccccc2c1/C=N/c1ccc(-c2cn3ccccc3n2)cc1
InChIInChI=1S/C24H17N3O/c28-23-13-10-17-5-1-2-6-20(17)21(23)15-25-19-11-8-18(9-12-19)22-16-27-14-4-3-7-24(27)26-22/h1-16,28H/b25-15+
InChIKeyQCNGURAQQCHBDL-MFKUBSTISA-N
XLogP5.61
TPSA49.89 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500363.42
LogP ≤ 55.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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-[(4-imidazo[1,2-a]pyridin-2-ylphenyl)iminomethyl]naphthalen-2-ol?
The IUPAC name of 1-[(4-imidazo[1,2-a]pyridin-2-ylphenyl)iminomethyl]naphthalen-2-ol (CID 135734215) is 1-[(4-imidazo[1,2-a]pyridin-2-ylphenyl)iminomethyl]naphthalen-2-ol.
What is the SMILES notation for 1-[(4-imidazo[1,2-a]pyridin-2-ylphenyl)iminomethyl]naphthalen-2-ol?
The canonical SMILES for 1-[(4-imidazo[1,2-a]pyridin-2-ylphenyl)iminomethyl]naphthalen-2-ol is Oc1ccc2ccccc2c1/C=N/c1ccc(-c2cn3ccccc3n2)cc1.
What is the InChIKey of 1-[(4-imidazo[1,2-a]pyridin-2-ylphenyl)iminomethyl]naphthalen-2-ol?
The InChIKey is QCNGURAQQCHBDL-MFKUBSTISA-N. The full InChI is InChI=1S/C24H17N3O/c28-23-13-10-17-5-1-2-6-20(17)21(23)15-25-19-11-8-18(9-12-19)22-16-27-14-4-3-7-24(27)26-22/h1-16,28H/b25-15+.
What are the key properties of 1-[(4-imidazo[1,2-a]pyridin-2-ylphenyl)iminomethyl]naphthalen-2-ol?
1-[(4-imidazo[1,2-a]pyridin-2-ylphenyl)iminomethyl]naphthalen-2-ol has a molecular weight of 363.42 g/mol, XLogP of 5.61, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-imidazo[1,2-a]pyridin-2-ylphenyl)iminomethyl]naphthalen-2-ol is sourced from PubChem (CID 135734215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).