6-(3-hydroxyphenyl)-1-(6-methoxy-3-pyridinyl)naphthalen-2-ol

C22H17NO3 — CID 25069763

IUPAC6-(3-hydroxyphenyl)-1-(6-methoxy-3-pyridinyl)naphthalen-2-ol
SMILESCOc1ccc(-c2c(O)ccc3cc(-c4cccc(O)c4)ccc23)cn1
InChIInChI=1S/C22H17NO3/c1-26-21-10-7-17(13-23-21)22-19-8-5-15(11-16(19)6-9-20(22)25)14-3-2-4-18(24)12-14/h2-13,24-25H,1H3
InChIKeyLGNVIXULXLACQS-UHFFFAOYSA-N
MW343.38 g/mol
LogP4.99
Rot. Bonds3

About 6-(3-hydroxyphenyl)-1-(6-methoxy-3-pyridinyl)naphthalen-2-ol

6-(3-hydroxyphenyl)-1-(6-methoxy-3-pyridinyl)naphthalen-2-ol (PubChem CID 25069763) has the molecular formula C22H17NO3 and a molecular weight of 343.38 g/mol. Its IUPAC name is 6-(3-hydroxyphenyl)-1-(6-methoxy-3-pyridinyl)naphthalen-2-ol.

Molecular Properties

Compound Name6-(3-hydroxyphenyl)-1-(6-methoxy-3-pyridinyl)naphthalen-2-ol
PubChem CID25069763
Molecular FormulaC22H17NO3
Molecular Weight343.38 g/mol
Exact Mass343.12
IUPAC Name6-(3-hydroxyphenyl)-1-(6-methoxy-3-pyridinyl)naphthalen-2-ol
SMILESCOc1ccc(-c2c(O)ccc3cc(-c4cccc(O)c4)ccc23)cn1
InChIInChI=1S/C22H17NO3/c1-26-21-10-7-17(13-23-21)22-19-8-5-15(11-16(19)6-9-20(22)25)14-3-2-4-18(24)12-14/h2-13,24-25H,1H3
InChIKeyLGNVIXULXLACQS-UHFFFAOYSA-N
XLogP4.99
TPSA62.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.38
LogP ≤ 54.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(3-hydroxyphenyl)-1-(6-methoxy-3-pyridinyl)naphthalen-2-ol?
The IUPAC name of 6-(3-hydroxyphenyl)-1-(6-methoxy-3-pyridinyl)naphthalen-2-ol (CID 25069763) is 6-(3-hydroxyphenyl)-1-(6-methoxy-3-pyridinyl)naphthalen-2-ol.
What is the SMILES notation for 6-(3-hydroxyphenyl)-1-(6-methoxy-3-pyridinyl)naphthalen-2-ol?
The canonical SMILES for 6-(3-hydroxyphenyl)-1-(6-methoxy-3-pyridinyl)naphthalen-2-ol is COc1ccc(-c2c(O)ccc3cc(-c4cccc(O)c4)ccc23)cn1.
What is the InChIKey of 6-(3-hydroxyphenyl)-1-(6-methoxy-3-pyridinyl)naphthalen-2-ol?
The InChIKey is LGNVIXULXLACQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17NO3/c1-26-21-10-7-17(13-23-21)22-19-8-5-15(11-16(19)6-9-20(22)25)14-3-2-4-18(24)12-14/h2-13,24-25H,1H3.
What are the key properties of 6-(3-hydroxyphenyl)-1-(6-methoxy-3-pyridinyl)naphthalen-2-ol?
6-(3-hydroxyphenyl)-1-(6-methoxy-3-pyridinyl)naphthalen-2-ol has a molecular weight of 343.38 g/mol, XLogP of 4.99, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-hydroxyphenyl)-1-(6-methoxy-3-pyridinyl)naphthalen-2-ol is sourced from PubChem (CID 25069763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).