4-(4-chlorophenyl)-1-[3-(4-fluorophenyl)propyl]piperidin-4-ol

C20H23ClFNO — CID 91379597

IUPAC4-(4-chlorophenyl)-1-[3-(4-fluorophenyl)propyl]piperidin-4-ol
SMILESOC1(c2ccc(Cl)cc2)CCN(CCCc2ccc(F)cc2)CC1
InChIInChI=1S/C20H23ClFNO/c21-18-7-5-17(6-8-18)20(24)11-14-23(15-12-20)13-1-2-16-3-9-19(22)10-4-16/h3-10,24H,1-2,11-15H2
InChIKeyAWJUFRDAWDELNC-UHFFFAOYSA-N
MW347.86 g/mol
LogP4.40
Rot. Bonds5

About 4-(4-chlorophenyl)-1-[3-(4-fluorophenyl)propyl]piperidin-4-ol

4-(4-chlorophenyl)-1-[3-(4-fluorophenyl)propyl]piperidin-4-ol (PubChem CID 91379597) has the molecular formula C20H23ClFNO and a molecular weight of 347.86 g/mol. Its IUPAC name is 4-(4-chlorophenyl)-1-[3-(4-fluorophenyl)propyl]piperidin-4-ol.

Molecular Properties

Compound Name4-(4-chlorophenyl)-1-[3-(4-fluorophenyl)propyl]piperidin-4-ol
PubChem CID91379597
Molecular FormulaC20H23ClFNO
Molecular Weight347.86 g/mol
Exact Mass347.15
IUPAC Name4-(4-chlorophenyl)-1-[3-(4-fluorophenyl)propyl]piperidin-4-ol
SMILESOC1(c2ccc(Cl)cc2)CCN(CCCc2ccc(F)cc2)CC1
InChIInChI=1S/C20H23ClFNO/c21-18-7-5-17(6-8-18)20(24)11-14-23(15-12-20)13-1-2-16-3-9-19(22)10-4-16/h3-10,24H,1-2,11-15H2
InChIKeyAWJUFRDAWDELNC-UHFFFAOYSA-N
XLogP4.40
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.86
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(4-chlorophenyl)-1-[3-(4-fluorophenyl)propyl]piperidin-4-ol?
The IUPAC name of 4-(4-chlorophenyl)-1-[3-(4-fluorophenyl)propyl]piperidin-4-ol (CID 91379597) is 4-(4-chlorophenyl)-1-[3-(4-fluorophenyl)propyl]piperidin-4-ol.
What is the SMILES notation for 4-(4-chlorophenyl)-1-[3-(4-fluorophenyl)propyl]piperidin-4-ol?
The canonical SMILES for 4-(4-chlorophenyl)-1-[3-(4-fluorophenyl)propyl]piperidin-4-ol is OC1(c2ccc(Cl)cc2)CCN(CCCc2ccc(F)cc2)CC1.
What is the InChIKey of 4-(4-chlorophenyl)-1-[3-(4-fluorophenyl)propyl]piperidin-4-ol?
The InChIKey is AWJUFRDAWDELNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23ClFNO/c21-18-7-5-17(6-8-18)20(24)11-14-23(15-12-20)13-1-2-16-3-9-19(22)10-4-16/h3-10,24H,1-2,11-15H2.
What are the key properties of 4-(4-chlorophenyl)-1-[3-(4-fluorophenyl)propyl]piperidin-4-ol?
4-(4-chlorophenyl)-1-[3-(4-fluorophenyl)propyl]piperidin-4-ol has a molecular weight of 347.86 g/mol, XLogP of 4.40, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chlorophenyl)-1-[3-(4-fluorophenyl)propyl]piperidin-4-ol is sourced from PubChem (CID 91379597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).