[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methanol

C18H15FO2 — CID 964391

IUPAC[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methanol
SMILESOCc1c(OCc2ccc(F)cc2)ccc2ccccc12
InChIInChI=1S/C18H15FO2/c19-15-8-5-13(6-9-15)12-21-18-10-7-14-3-1-2-4-16(14)17(18)11-20/h1-10,20H,11-12H2
InChIKeyDQAKCYQSZVURMH-UHFFFAOYSA-N
MW282.31 g/mol
LogP4.05
Rot. Bonds4

About [2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methanol

[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methanol (PubChem CID 964391) has the molecular formula C18H15FO2 and a molecular weight of 282.31 g/mol. Its IUPAC name is [2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methanol.

Molecular Properties

Compound Name[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methanol
PubChem CID964391
Molecular FormulaC18H15FO2
Molecular Weight282.31 g/mol
Exact Mass282.11
IUPAC Name[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methanol
SMILESOCc1c(OCc2ccc(F)cc2)ccc2ccccc12
InChIInChI=1S/C18H15FO2/c19-15-8-5-13(6-9-15)12-21-18-10-7-14-3-1-2-4-16(14)17(18)11-20/h1-10,20H,11-12H2
InChIKeyDQAKCYQSZVURMH-UHFFFAOYSA-N
XLogP4.05
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.31
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methanol?
The IUPAC name of [2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methanol (CID 964391) is [2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methanol.
What is the SMILES notation for [2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methanol?
The canonical SMILES for [2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methanol is OCc1c(OCc2ccc(F)cc2)ccc2ccccc12.
What is the InChIKey of [2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methanol?
The InChIKey is DQAKCYQSZVURMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FO2/c19-15-8-5-13(6-9-15)12-21-18-10-7-14-3-1-2-4-16(14)17(18)11-20/h1-10,20H,11-12H2.
What are the key properties of [2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methanol?
[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methanol has a molecular weight of 282.31 g/mol, XLogP of 4.05, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methanol is sourced from PubChem (CID 964391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).