6-(3-hydroxyphenyl)-1-pyridin-4-ylnaphthalen-2-ol

C21H15NO2 — CID 135955190

IUPAC6-(3-hydroxyphenyl)-1-pyridin-4-ylnaphthalen-2-ol
SMILESOc1cccc(-c2ccc3c(-c4ccncc4)c(O)ccc3c2)c1
InChIInChI=1S/C21H15NO2/c23-18-3-1-2-15(13-18)16-4-6-19-17(12-16)5-7-20(24)21(19)14-8-10-22-11-9-14/h1-13,23-24H
InChIKeyLQVXBXGVWKFEJF-UHFFFAOYSA-N
MW313.36 g/mol
LogP4.98
Rot. Bonds2

About 6-(3-hydroxyphenyl)-1-pyridin-4-ylnaphthalen-2-ol

6-(3-hydroxyphenyl)-1-pyridin-4-ylnaphthalen-2-ol (PubChem CID 135955190) has the molecular formula C21H15NO2 and a molecular weight of 313.36 g/mol. Its IUPAC name is 6-(3-hydroxyphenyl)-1-pyridin-4-ylnaphthalen-2-ol.

Molecular Properties

Compound Name6-(3-hydroxyphenyl)-1-pyridin-4-ylnaphthalen-2-ol
PubChem CID135955190
Molecular FormulaC21H15NO2
Molecular Weight313.36 g/mol
Exact Mass313.11
IUPAC Name6-(3-hydroxyphenyl)-1-pyridin-4-ylnaphthalen-2-ol
SMILESOc1cccc(-c2ccc3c(-c4ccncc4)c(O)ccc3c2)c1
InChIInChI=1S/C21H15NO2/c23-18-3-1-2-15(13-18)16-4-6-19-17(12-16)5-7-20(24)21(19)14-8-10-22-11-9-14/h1-13,23-24H
InChIKeyLQVXBXGVWKFEJF-UHFFFAOYSA-N
XLogP4.98
TPSA53.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 54.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(3-hydroxyphenyl)-1-pyridin-4-ylnaphthalen-2-ol?
The IUPAC name of 6-(3-hydroxyphenyl)-1-pyridin-4-ylnaphthalen-2-ol (CID 135955190) is 6-(3-hydroxyphenyl)-1-pyridin-4-ylnaphthalen-2-ol.
What is the SMILES notation for 6-(3-hydroxyphenyl)-1-pyridin-4-ylnaphthalen-2-ol?
The canonical SMILES for 6-(3-hydroxyphenyl)-1-pyridin-4-ylnaphthalen-2-ol is Oc1cccc(-c2ccc3c(-c4ccncc4)c(O)ccc3c2)c1.
What is the InChIKey of 6-(3-hydroxyphenyl)-1-pyridin-4-ylnaphthalen-2-ol?
The InChIKey is LQVXBXGVWKFEJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15NO2/c23-18-3-1-2-15(13-18)16-4-6-19-17(12-16)5-7-20(24)21(19)14-8-10-22-11-9-14/h1-13,23-24H.
What are the key properties of 6-(3-hydroxyphenyl)-1-pyridin-4-ylnaphthalen-2-ol?
6-(3-hydroxyphenyl)-1-pyridin-4-ylnaphthalen-2-ol has a molecular weight of 313.36 g/mol, XLogP of 4.98, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-hydroxyphenyl)-1-pyridin-4-ylnaphthalen-2-ol is sourced from PubChem (CID 135955190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).