4-(4-fluorophenyl)-1,3-dimethyl-2,6-diphenylpiperidin-4-ol

C25H26FNO — CID 2729786

IUPAC4-(4-fluorophenyl)-1,3-dimethyl-2,6-diphenylpiperidin-4-ol
SMILESCC1C(c2ccccc2)N(C)C(c2ccccc2)CC1(O)c1ccc(F)cc1
InChIInChI=1S/C25H26FNO/c1-18-24(20-11-7-4-8-12-20)27(2)23(19-9-5-3-6-10-19)17-25(18,28)21-13-15-22(26)16-14-21/h3-16,18,23-24,28H,17H2,1-2H3
InChIKeyNTQGEZJOMVFLMK-UHFFFAOYSA-N
MW375.49 g/mol
LogP5.47
Rot. Bonds3

About 4-(4-fluorophenyl)-1,3-dimethyl-2,6-diphenylpiperidin-4-ol

4-(4-fluorophenyl)-1,3-dimethyl-2,6-diphenylpiperidin-4-ol (PubChem CID 2729786) has the molecular formula C25H26FNO and a molecular weight of 375.49 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-1,3-dimethyl-2,6-diphenylpiperidin-4-ol.

Molecular Properties

Compound Name4-(4-fluorophenyl)-1,3-dimethyl-2,6-diphenylpiperidin-4-ol
PubChem CID2729786
Molecular FormulaC25H26FNO
Molecular Weight375.49 g/mol
Exact Mass375.20
IUPAC Name4-(4-fluorophenyl)-1,3-dimethyl-2,6-diphenylpiperidin-4-ol
SMILESCC1C(c2ccccc2)N(C)C(c2ccccc2)CC1(O)c1ccc(F)cc1
InChIInChI=1S/C25H26FNO/c1-18-24(20-11-7-4-8-12-20)27(2)23(19-9-5-3-6-10-19)17-25(18,28)21-13-15-22(26)16-14-21/h3-16,18,23-24,28H,17H2,1-2H3
InChIKeyNTQGEZJOMVFLMK-UHFFFAOYSA-N
XLogP5.47
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.49
LogP ≤ 55.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-1,3-dimethyl-2,6-diphenylpiperidin-4-ol?
The IUPAC name of 4-(4-fluorophenyl)-1,3-dimethyl-2,6-diphenylpiperidin-4-ol (CID 2729786) is 4-(4-fluorophenyl)-1,3-dimethyl-2,6-diphenylpiperidin-4-ol.
What is the SMILES notation for 4-(4-fluorophenyl)-1,3-dimethyl-2,6-diphenylpiperidin-4-ol?
The canonical SMILES for 4-(4-fluorophenyl)-1,3-dimethyl-2,6-diphenylpiperidin-4-ol is CC1C(c2ccccc2)N(C)C(c2ccccc2)CC1(O)c1ccc(F)cc1.
What is the InChIKey of 4-(4-fluorophenyl)-1,3-dimethyl-2,6-diphenylpiperidin-4-ol?
The InChIKey is NTQGEZJOMVFLMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26FNO/c1-18-24(20-11-7-4-8-12-20)27(2)23(19-9-5-3-6-10-19)17-25(18,28)21-13-15-22(26)16-14-21/h3-16,18,23-24,28H,17H2,1-2H3.
What are the key properties of 4-(4-fluorophenyl)-1,3-dimethyl-2,6-diphenylpiperidin-4-ol?
4-(4-fluorophenyl)-1,3-dimethyl-2,6-diphenylpiperidin-4-ol has a molecular weight of 375.49 g/mol, XLogP of 5.47, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-1,3-dimethyl-2,6-diphenylpiperidin-4-ol is sourced from PubChem (CID 2729786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).