[1,2-bis(4-fluorophenyl)piperidin-4-yl]methanol

C18H19F2NO — CID 70282501

IUPAC[1,2-bis(4-fluorophenyl)piperidin-4-yl]methanol
SMILESOCC1CCN(c2ccc(F)cc2)C(c2ccc(F)cc2)C1
InChIInChI=1S/C18H19F2NO/c19-15-3-1-14(2-4-15)18-11-13(12-22)9-10-21(18)17-7-5-16(20)6-8-17/h1-8,13,18,22H,9-12H2
InChIKeyADSJZUZOJYHAJX-UHFFFAOYSA-N
MW303.35 g/mol
LogP3.91
Rot. Bonds3

About [1,2-bis(4-fluorophenyl)piperidin-4-yl]methanol

[1,2-bis(4-fluorophenyl)piperidin-4-yl]methanol (PubChem CID 70282501) has the molecular formula C18H19F2NO and a molecular weight of 303.35 g/mol. Its IUPAC name is [1,2-bis(4-fluorophenyl)piperidin-4-yl]methanol.

Molecular Properties

Compound Name[1,2-bis(4-fluorophenyl)piperidin-4-yl]methanol
PubChem CID70282501
Molecular FormulaC18H19F2NO
Molecular Weight303.35 g/mol
Exact Mass303.14
IUPAC Name[1,2-bis(4-fluorophenyl)piperidin-4-yl]methanol
SMILESOCC1CCN(c2ccc(F)cc2)C(c2ccc(F)cc2)C1
InChIInChI=1S/C18H19F2NO/c19-15-3-1-14(2-4-15)18-11-13(12-22)9-10-21(18)17-7-5-16(20)6-8-17/h1-8,13,18,22H,9-12H2
InChIKeyADSJZUZOJYHAJX-UHFFFAOYSA-N
XLogP3.91
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.35
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1,2-bis(4-fluorophenyl)piperidin-4-yl]methanol?
The IUPAC name of [1,2-bis(4-fluorophenyl)piperidin-4-yl]methanol (CID 70282501) is [1,2-bis(4-fluorophenyl)piperidin-4-yl]methanol.
What is the SMILES notation for [1,2-bis(4-fluorophenyl)piperidin-4-yl]methanol?
The canonical SMILES for [1,2-bis(4-fluorophenyl)piperidin-4-yl]methanol is OCC1CCN(c2ccc(F)cc2)C(c2ccc(F)cc2)C1.
What is the InChIKey of [1,2-bis(4-fluorophenyl)piperidin-4-yl]methanol?
The InChIKey is ADSJZUZOJYHAJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19F2NO/c19-15-3-1-14(2-4-15)18-11-13(12-22)9-10-21(18)17-7-5-16(20)6-8-17/h1-8,13,18,22H,9-12H2.
What are the key properties of [1,2-bis(4-fluorophenyl)piperidin-4-yl]methanol?
[1,2-bis(4-fluorophenyl)piperidin-4-yl]methanol has a molecular weight of 303.35 g/mol, XLogP of 3.91, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1,2-bis(4-fluorophenyl)piperidin-4-yl]methanol is sourced from PubChem (CID 70282501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).