[4-(2-fluorophenyl)-2-methoxy-5-(2-methylcyclopentyl)phenyl]methanol

C20H23FO2 — CID 68796606

IUPAC[4-(2-fluorophenyl)-2-methoxy-5-(2-methylcyclopentyl)phenyl]methanol
SMILESCOc1cc(-c2ccccc2F)c(C2CCCC2C)cc1CO
InChIInChI=1S/C20H23FO2/c1-13-6-5-8-15(13)17-10-14(12-22)20(23-2)11-18(17)16-7-3-4-9-19(16)21/h3-4,7,9-11,13,15,22H,5-6,8,12H2,1-2H3
InChIKeyCIVCOHWMXODWKJ-UHFFFAOYSA-N
MW314.40 g/mol
LogP4.90
Rot. Bonds4

About [4-(2-fluorophenyl)-2-methoxy-5-(2-methylcyclopentyl)phenyl]methanol

[4-(2-fluorophenyl)-2-methoxy-5-(2-methylcyclopentyl)phenyl]methanol (PubChem CID 68796606) has the molecular formula C20H23FO2 and a molecular weight of 314.40 g/mol. Its IUPAC name is [4-(2-fluorophenyl)-2-methoxy-5-(2-methylcyclopentyl)phenyl]methanol.

Molecular Properties

Compound Name[4-(2-fluorophenyl)-2-methoxy-5-(2-methylcyclopentyl)phenyl]methanol
PubChem CID68796606
Molecular FormulaC20H23FO2
Molecular Weight314.40 g/mol
Exact Mass314.17
IUPAC Name[4-(2-fluorophenyl)-2-methoxy-5-(2-methylcyclopentyl)phenyl]methanol
SMILESCOc1cc(-c2ccccc2F)c(C2CCCC2C)cc1CO
InChIInChI=1S/C20H23FO2/c1-13-6-5-8-15(13)17-10-14(12-22)20(23-2)11-18(17)16-7-3-4-9-19(16)21/h3-4,7,9-11,13,15,22H,5-6,8,12H2,1-2H3
InChIKeyCIVCOHWMXODWKJ-UHFFFAOYSA-N
XLogP4.90
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.40
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [4-(2-fluorophenyl)-2-methoxy-5-(2-methylcyclopentyl)phenyl]methanol?
The IUPAC name of [4-(2-fluorophenyl)-2-methoxy-5-(2-methylcyclopentyl)phenyl]methanol (CID 68796606) is [4-(2-fluorophenyl)-2-methoxy-5-(2-methylcyclopentyl)phenyl]methanol.
What is the SMILES notation for [4-(2-fluorophenyl)-2-methoxy-5-(2-methylcyclopentyl)phenyl]methanol?
The canonical SMILES for [4-(2-fluorophenyl)-2-methoxy-5-(2-methylcyclopentyl)phenyl]methanol is COc1cc(-c2ccccc2F)c(C2CCCC2C)cc1CO.
What is the InChIKey of [4-(2-fluorophenyl)-2-methoxy-5-(2-methylcyclopentyl)phenyl]methanol?
The InChIKey is CIVCOHWMXODWKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23FO2/c1-13-6-5-8-15(13)17-10-14(12-22)20(23-2)11-18(17)16-7-3-4-9-19(16)21/h3-4,7,9-11,13,15,22H,5-6,8,12H2,1-2H3.
What are the key properties of [4-(2-fluorophenyl)-2-methoxy-5-(2-methylcyclopentyl)phenyl]methanol?
[4-(2-fluorophenyl)-2-methoxy-5-(2-methylcyclopentyl)phenyl]methanol has a molecular weight of 314.40 g/mol, XLogP of 4.90, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-fluorophenyl)-2-methoxy-5-(2-methylcyclopentyl)phenyl]methanol is sourced from PubChem (CID 68796606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).