[1-[1-(4-fluorophenyl)ethyl]piperidin-4-yl]-phenylmethanol

C20H24FNO — CID 19820634

IUPAC[1-[1-(4-fluorophenyl)ethyl]piperidin-4-yl]-phenylmethanol
SMILESCC(c1ccc(F)cc1)N1CCC(C(O)c2ccccc2)CC1
InChIInChI=1S/C20H24FNO/c1-15(16-7-9-19(21)10-8-16)22-13-11-18(12-14-22)20(23)17-5-3-2-4-6-17/h2-10,15,18,20,23H,11-14H2,1H3
InChIKeyJHGXYPNAZLUOSN-UHFFFAOYSA-N
MW313.42 g/mol
LogP4.33
Rot. Bonds4

About [1-[1-(4-fluorophenyl)ethyl]piperidin-4-yl]-phenylmethanol

[1-[1-(4-fluorophenyl)ethyl]piperidin-4-yl]-phenylmethanol (PubChem CID 19820634) has the molecular formula C20H24FNO and a molecular weight of 313.42 g/mol. Its IUPAC name is [1-[1-(4-fluorophenyl)ethyl]piperidin-4-yl]-phenylmethanol.

Molecular Properties

Compound Name[1-[1-(4-fluorophenyl)ethyl]piperidin-4-yl]-phenylmethanol
PubChem CID19820634
Molecular FormulaC20H24FNO
Molecular Weight313.42 g/mol
Exact Mass313.18
IUPAC Name[1-[1-(4-fluorophenyl)ethyl]piperidin-4-yl]-phenylmethanol
SMILESCC(c1ccc(F)cc1)N1CCC(C(O)c2ccccc2)CC1
InChIInChI=1S/C20H24FNO/c1-15(16-7-9-19(21)10-8-16)22-13-11-18(12-14-22)20(23)17-5-3-2-4-6-17/h2-10,15,18,20,23H,11-14H2,1H3
InChIKeyJHGXYPNAZLUOSN-UHFFFAOYSA-N
XLogP4.33
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.42
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-[1-(4-fluorophenyl)ethyl]piperidin-4-yl]-phenylmethanol?
The IUPAC name of [1-[1-(4-fluorophenyl)ethyl]piperidin-4-yl]-phenylmethanol (CID 19820634) is [1-[1-(4-fluorophenyl)ethyl]piperidin-4-yl]-phenylmethanol.
What is the SMILES notation for [1-[1-(4-fluorophenyl)ethyl]piperidin-4-yl]-phenylmethanol?
The canonical SMILES for [1-[1-(4-fluorophenyl)ethyl]piperidin-4-yl]-phenylmethanol is CC(c1ccc(F)cc1)N1CCC(C(O)c2ccccc2)CC1.
What is the InChIKey of [1-[1-(4-fluorophenyl)ethyl]piperidin-4-yl]-phenylmethanol?
The InChIKey is JHGXYPNAZLUOSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24FNO/c1-15(16-7-9-19(21)10-8-16)22-13-11-18(12-14-22)20(23)17-5-3-2-4-6-17/h2-10,15,18,20,23H,11-14H2,1H3.
What are the key properties of [1-[1-(4-fluorophenyl)ethyl]piperidin-4-yl]-phenylmethanol?
[1-[1-(4-fluorophenyl)ethyl]piperidin-4-yl]-phenylmethanol has a molecular weight of 313.42 g/mol, XLogP of 4.33, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[1-(4-fluorophenyl)ethyl]piperidin-4-yl]-phenylmethanol is sourced from PubChem (CID 19820634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).