4-(4-fluorophenyl)-1-[[4-(4-fluorophenyl)-2-pyridinyl]methyl]piperidin-4-ol

C23H22F2N2O — CID 19863494

IUPAC4-(4-fluorophenyl)-1-[[4-(4-fluorophenyl)-2-pyridinyl]methyl]piperidin-4-ol
SMILESOC1(c2ccc(F)cc2)CCN(Cc2cc(-c3ccc(F)cc3)ccn2)CC1
InChIInChI=1S/C23H22F2N2O/c24-20-5-1-17(2-6-20)18-9-12-26-22(15-18)16-27-13-10-23(28,11-14-27)19-3-7-21(25)8-4-19/h1-9,12,15,28H,10-11,13-14,16H2
InChIKeyKBRURARJQYPLHY-UHFFFAOYSA-N
MW380.44 g/mol
LogP4.51
Rot. Bonds4

About 4-(4-fluorophenyl)-1-[[4-(4-fluorophenyl)-2-pyridinyl]methyl]piperidin-4-ol

4-(4-fluorophenyl)-1-[[4-(4-fluorophenyl)-2-pyridinyl]methyl]piperidin-4-ol (PubChem CID 19863494) has the molecular formula C23H22F2N2O and a molecular weight of 380.44 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-1-[[4-(4-fluorophenyl)-2-pyridinyl]methyl]piperidin-4-ol.

Molecular Properties

Compound Name4-(4-fluorophenyl)-1-[[4-(4-fluorophenyl)-2-pyridinyl]methyl]piperidin-4-ol
PubChem CID19863494
Molecular FormulaC23H22F2N2O
Molecular Weight380.44 g/mol
Exact Mass380.17
IUPAC Name4-(4-fluorophenyl)-1-[[4-(4-fluorophenyl)-2-pyridinyl]methyl]piperidin-4-ol
SMILESOC1(c2ccc(F)cc2)CCN(Cc2cc(-c3ccc(F)cc3)ccn2)CC1
InChIInChI=1S/C23H22F2N2O/c24-20-5-1-17(2-6-20)18-9-12-26-22(15-18)16-27-13-10-23(28,11-14-27)19-3-7-21(25)8-4-19/h1-9,12,15,28H,10-11,13-14,16H2
InChIKeyKBRURARJQYPLHY-UHFFFAOYSA-N
XLogP4.51
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.44
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-1-[[4-(4-fluorophenyl)-2-pyridinyl]methyl]piperidin-4-ol?
The IUPAC name of 4-(4-fluorophenyl)-1-[[4-(4-fluorophenyl)-2-pyridinyl]methyl]piperidin-4-ol (CID 19863494) is 4-(4-fluorophenyl)-1-[[4-(4-fluorophenyl)-2-pyridinyl]methyl]piperidin-4-ol.
What is the SMILES notation for 4-(4-fluorophenyl)-1-[[4-(4-fluorophenyl)-2-pyridinyl]methyl]piperidin-4-ol?
The canonical SMILES for 4-(4-fluorophenyl)-1-[[4-(4-fluorophenyl)-2-pyridinyl]methyl]piperidin-4-ol is OC1(c2ccc(F)cc2)CCN(Cc2cc(-c3ccc(F)cc3)ccn2)CC1.
What is the InChIKey of 4-(4-fluorophenyl)-1-[[4-(4-fluorophenyl)-2-pyridinyl]methyl]piperidin-4-ol?
The InChIKey is KBRURARJQYPLHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22F2N2O/c24-20-5-1-17(2-6-20)18-9-12-26-22(15-18)16-27-13-10-23(28,11-14-27)19-3-7-21(25)8-4-19/h1-9,12,15,28H,10-11,13-14,16H2.
What are the key properties of 4-(4-fluorophenyl)-1-[[4-(4-fluorophenyl)-2-pyridinyl]methyl]piperidin-4-ol?
4-(4-fluorophenyl)-1-[[4-(4-fluorophenyl)-2-pyridinyl]methyl]piperidin-4-ol has a molecular weight of 380.44 g/mol, XLogP of 4.51, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-1-[[4-(4-fluorophenyl)-2-pyridinyl]methyl]piperidin-4-ol is sourced from PubChem (CID 19863494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).