2-(2-fluorophenyl)-5-methoxy-2-(4-methoxyphenyl)-1H-naphthalene

C24H21FO2 — CID 57122950

IUPAC2-(2-fluorophenyl)-5-methoxy-2-(4-methoxyphenyl)-1H-naphthalene
SMILESCOc1ccc(C2(c3ccccc3F)C=Cc3c(cccc3OC)C2)cc1
InChIInChI=1S/C24H21FO2/c1-26-19-12-10-18(11-13-19)24(21-7-3-4-8-22(21)25)15-14-20-17(16-24)6-5-9-23(20)27-2/h3-15H,16H2,1-2H3
InChIKeyWRXRJJFAGLULPY-UHFFFAOYSA-N
MW360.43 g/mol
LogP5.40
Rot. Bonds4

About 2-(2-fluorophenyl)-5-methoxy-2-(4-methoxyphenyl)-1H-naphthalene

2-(2-fluorophenyl)-5-methoxy-2-(4-methoxyphenyl)-1H-naphthalene (PubChem CID 57122950) has the molecular formula C24H21FO2 and a molecular weight of 360.43 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-5-methoxy-2-(4-methoxyphenyl)-1H-naphthalene.

Molecular Properties

Compound Name2-(2-fluorophenyl)-5-methoxy-2-(4-methoxyphenyl)-1H-naphthalene
PubChem CID57122950
Molecular FormulaC24H21FO2
Molecular Weight360.43 g/mol
Exact Mass360.15
IUPAC Name2-(2-fluorophenyl)-5-methoxy-2-(4-methoxyphenyl)-1H-naphthalene
SMILESCOc1ccc(C2(c3ccccc3F)C=Cc3c(cccc3OC)C2)cc1
InChIInChI=1S/C24H21FO2/c1-26-19-12-10-18(11-13-19)24(21-7-3-4-8-22(21)25)15-14-20-17(16-24)6-5-9-23(20)27-2/h3-15H,16H2,1-2H3
InChIKeyWRXRJJFAGLULPY-UHFFFAOYSA-N
XLogP5.40
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.43
LogP ≤ 55.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-5-methoxy-2-(4-methoxyphenyl)-1H-naphthalene?
The IUPAC name of 2-(2-fluorophenyl)-5-methoxy-2-(4-methoxyphenyl)-1H-naphthalene (CID 57122950) is 2-(2-fluorophenyl)-5-methoxy-2-(4-methoxyphenyl)-1H-naphthalene.
What is the SMILES notation for 2-(2-fluorophenyl)-5-methoxy-2-(4-methoxyphenyl)-1H-naphthalene?
The canonical SMILES for 2-(2-fluorophenyl)-5-methoxy-2-(4-methoxyphenyl)-1H-naphthalene is COc1ccc(C2(c3ccccc3F)C=Cc3c(cccc3OC)C2)cc1.
What is the InChIKey of 2-(2-fluorophenyl)-5-methoxy-2-(4-methoxyphenyl)-1H-naphthalene?
The InChIKey is WRXRJJFAGLULPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21FO2/c1-26-19-12-10-18(11-13-19)24(21-7-3-4-8-22(21)25)15-14-20-17(16-24)6-5-9-23(20)27-2/h3-15H,16H2,1-2H3.
What are the key properties of 2-(2-fluorophenyl)-5-methoxy-2-(4-methoxyphenyl)-1H-naphthalene?
2-(2-fluorophenyl)-5-methoxy-2-(4-methoxyphenyl)-1H-naphthalene has a molecular weight of 360.43 g/mol, XLogP of 5.40, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-5-methoxy-2-(4-methoxyphenyl)-1H-naphthalene is sourced from PubChem (CID 57122950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).