5,8-bis(phenylmethoxy)naphthalen-2-ol

C24H20O3 — CID 139679004

IUPAC5,8-bis(phenylmethoxy)naphthalen-2-ol
SMILESOc1ccc2c(OCc3ccccc3)ccc(OCc3ccccc3)c2c1
InChIInChI=1S/C24H20O3/c25-20-11-12-21-22(15-20)24(27-17-19-9-5-2-6-10-19)14-13-23(21)26-16-18-7-3-1-4-8-18/h1-15,25H,16-17H2
InChIKeyIETDQOVMLJQWFE-UHFFFAOYSA-N
MW356.42 g/mol
LogP5.70
Rot. Bonds6

About 5,8-bis(phenylmethoxy)naphthalen-2-ol

5,8-bis(phenylmethoxy)naphthalen-2-ol (PubChem CID 139679004) has the molecular formula C24H20O3 and a molecular weight of 356.42 g/mol. Its IUPAC name is 5,8-bis(phenylmethoxy)naphthalen-2-ol.

Molecular Properties

Compound Name5,8-bis(phenylmethoxy)naphthalen-2-ol
PubChem CID139679004
Molecular FormulaC24H20O3
Molecular Weight356.42 g/mol
Exact Mass356.14
IUPAC Name5,8-bis(phenylmethoxy)naphthalen-2-ol
SMILESOc1ccc2c(OCc3ccccc3)ccc(OCc3ccccc3)c2c1
InChIInChI=1S/C24H20O3/c25-20-11-12-21-22(15-20)24(27-17-19-9-5-2-6-10-19)14-13-23(21)26-16-18-7-3-1-4-8-18/h1-15,25H,16-17H2
InChIKeyIETDQOVMLJQWFE-UHFFFAOYSA-N
XLogP5.70
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500356.42
LogP ≤ 55.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5,8-bis(phenylmethoxy)naphthalen-2-ol?
The IUPAC name of 5,8-bis(phenylmethoxy)naphthalen-2-ol (CID 139679004) is 5,8-bis(phenylmethoxy)naphthalen-2-ol.
What is the SMILES notation for 5,8-bis(phenylmethoxy)naphthalen-2-ol?
The canonical SMILES for 5,8-bis(phenylmethoxy)naphthalen-2-ol is Oc1ccc2c(OCc3ccccc3)ccc(OCc3ccccc3)c2c1.
What is the InChIKey of 5,8-bis(phenylmethoxy)naphthalen-2-ol?
The InChIKey is IETDQOVMLJQWFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20O3/c25-20-11-12-21-22(15-20)24(27-17-19-9-5-2-6-10-19)14-13-23(21)26-16-18-7-3-1-4-8-18/h1-15,25H,16-17H2.
What are the key properties of 5,8-bis(phenylmethoxy)naphthalen-2-ol?
5,8-bis(phenylmethoxy)naphthalen-2-ol has a molecular weight of 356.42 g/mol, XLogP of 5.70, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,8-bis(phenylmethoxy)naphthalen-2-ol is sourced from PubChem (CID 139679004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).