2-[(4-phenylmethoxyphenyl)methyl]naphthalen-1-ol

C24H20O2 — CID 15617841

IUPAC2-[(4-phenylmethoxyphenyl)methyl]naphthalen-1-ol
SMILESOc1c(Cc2ccc(OCc3ccccc3)cc2)ccc2ccccc12
InChIInChI=1S/C24H20O2/c25-24-21(13-12-20-8-4-5-9-23(20)24)16-18-10-14-22(15-11-18)26-17-19-6-2-1-3-7-19/h1-15,25H,16-17H2
InChIKeyRFCUBSKNIQBDQL-UHFFFAOYSA-N
MW340.42 g/mol
LogP5.72
Rot. Bonds5

About 2-[(4-phenylmethoxyphenyl)methyl]naphthalen-1-ol

2-[(4-phenylmethoxyphenyl)methyl]naphthalen-1-ol (PubChem CID 15617841) has the molecular formula C24H20O2 and a molecular weight of 340.42 g/mol. Its IUPAC name is 2-[(4-phenylmethoxyphenyl)methyl]naphthalen-1-ol.

Molecular Properties

Compound Name2-[(4-phenylmethoxyphenyl)methyl]naphthalen-1-ol
PubChem CID15617841
Molecular FormulaC24H20O2
Molecular Weight340.42 g/mol
Exact Mass340.15
IUPAC Name2-[(4-phenylmethoxyphenyl)methyl]naphthalen-1-ol
SMILESOc1c(Cc2ccc(OCc3ccccc3)cc2)ccc2ccccc12
InChIInChI=1S/C24H20O2/c25-24-21(13-12-20-8-4-5-9-23(20)24)16-18-10-14-22(15-11-18)26-17-19-6-2-1-3-7-19/h1-15,25H,16-17H2
InChIKeyRFCUBSKNIQBDQL-UHFFFAOYSA-N
XLogP5.72
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.42
LogP ≤ 55.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-phenylmethoxyphenyl)methyl]naphthalen-1-ol?
The IUPAC name of 2-[(4-phenylmethoxyphenyl)methyl]naphthalen-1-ol (CID 15617841) is 2-[(4-phenylmethoxyphenyl)methyl]naphthalen-1-ol.
What is the SMILES notation for 2-[(4-phenylmethoxyphenyl)methyl]naphthalen-1-ol?
The canonical SMILES for 2-[(4-phenylmethoxyphenyl)methyl]naphthalen-1-ol is Oc1c(Cc2ccc(OCc3ccccc3)cc2)ccc2ccccc12.
What is the InChIKey of 2-[(4-phenylmethoxyphenyl)methyl]naphthalen-1-ol?
The InChIKey is RFCUBSKNIQBDQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20O2/c25-24-21(13-12-20-8-4-5-9-23(20)24)16-18-10-14-22(15-11-18)26-17-19-6-2-1-3-7-19/h1-15,25H,16-17H2.
What are the key properties of 2-[(4-phenylmethoxyphenyl)methyl]naphthalen-1-ol?
2-[(4-phenylmethoxyphenyl)methyl]naphthalen-1-ol has a molecular weight of 340.42 g/mol, XLogP of 5.72, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-phenylmethoxyphenyl)methyl]naphthalen-1-ol is sourced from PubChem (CID 15617841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).