6-(4-hydroxy-3-methoxyphenyl)naphthalen-1-ol

C17H14O3 — CID 56648216

IUPAC6-(4-hydroxy-3-methoxyphenyl)naphthalen-1-ol
SMILESCOc1cc(-c2ccc3c(O)cccc3c2)ccc1O
InChIInChI=1S/C17H14O3/c1-20-17-10-12(6-8-16(17)19)11-5-7-14-13(9-11)3-2-4-15(14)18/h2-10,18-19H,1H3
InChIKeyMUGYNLCHSCBNCY-UHFFFAOYSA-N
MW266.30 g/mol
LogP3.93
Rot. Bonds2

About 6-(4-hydroxy-3-methoxyphenyl)naphthalen-1-ol

6-(4-hydroxy-3-methoxyphenyl)naphthalen-1-ol (PubChem CID 56648216) has the molecular formula C17H14O3 and a molecular weight of 266.30 g/mol. Its IUPAC name is 6-(4-hydroxy-3-methoxyphenyl)naphthalen-1-ol.

Molecular Properties

Compound Name6-(4-hydroxy-3-methoxyphenyl)naphthalen-1-ol
PubChem CID56648216
Molecular FormulaC17H14O3
Molecular Weight266.30 g/mol
Exact Mass266.09
IUPAC Name6-(4-hydroxy-3-methoxyphenyl)naphthalen-1-ol
SMILESCOc1cc(-c2ccc3c(O)cccc3c2)ccc1O
InChIInChI=1S/C17H14O3/c1-20-17-10-12(6-8-16(17)19)11-5-7-14-13(9-11)3-2-4-15(14)18/h2-10,18-19H,1H3
InChIKeyMUGYNLCHSCBNCY-UHFFFAOYSA-N
XLogP3.93
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 53.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(4-hydroxy-3-methoxyphenyl)naphthalen-1-ol?
The IUPAC name of 6-(4-hydroxy-3-methoxyphenyl)naphthalen-1-ol (CID 56648216) is 6-(4-hydroxy-3-methoxyphenyl)naphthalen-1-ol.
What is the SMILES notation for 6-(4-hydroxy-3-methoxyphenyl)naphthalen-1-ol?
The canonical SMILES for 6-(4-hydroxy-3-methoxyphenyl)naphthalen-1-ol is COc1cc(-c2ccc3c(O)cccc3c2)ccc1O.
What is the InChIKey of 6-(4-hydroxy-3-methoxyphenyl)naphthalen-1-ol?
The InChIKey is MUGYNLCHSCBNCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14O3/c1-20-17-10-12(6-8-16(17)19)11-5-7-14-13(9-11)3-2-4-15(14)18/h2-10,18-19H,1H3.
What are the key properties of 6-(4-hydroxy-3-methoxyphenyl)naphthalen-1-ol?
6-(4-hydroxy-3-methoxyphenyl)naphthalen-1-ol has a molecular weight of 266.30 g/mol, XLogP of 3.93, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-hydroxy-3-methoxyphenyl)naphthalen-1-ol is sourced from PubChem (CID 56648216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).