1,1,3-triphenyl-2-piperidin-1-ylpropan-1-ol

C26H29NO — CID 23250666

IUPAC1,1,3-triphenyl-2-piperidin-1-ylpropan-1-ol
SMILESOC(c1ccccc1)(c1ccccc1)C(Cc1ccccc1)N1CCCCC1
InChIInChI=1S/C26H29NO/c28-26(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25(27-19-11-4-12-20-27)21-22-13-5-1-6-14-22/h1-3,5-10,13-18,25,28H,4,11-12,19-21H2
InChIKeyAYHQYINAUHMOPU-UHFFFAOYSA-N
MW371.52 g/mol
LogP5.02
Rot. Bonds6

About 1,1,3-triphenyl-2-piperidin-1-ylpropan-1-ol

1,1,3-triphenyl-2-piperidin-1-ylpropan-1-ol (PubChem CID 23250666) has the molecular formula C26H29NO and a molecular weight of 371.52 g/mol. Its IUPAC name is 1,1,3-triphenyl-2-piperidin-1-ylpropan-1-ol.

Molecular Properties

Compound Name1,1,3-triphenyl-2-piperidin-1-ylpropan-1-ol
PubChem CID23250666
Molecular FormulaC26H29NO
Molecular Weight371.52 g/mol
Exact Mass371.22
IUPAC Name1,1,3-triphenyl-2-piperidin-1-ylpropan-1-ol
SMILESOC(c1ccccc1)(c1ccccc1)C(Cc1ccccc1)N1CCCCC1
InChIInChI=1S/C26H29NO/c28-26(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25(27-19-11-4-12-20-27)21-22-13-5-1-6-14-22/h1-3,5-10,13-18,25,28H,4,11-12,19-21H2
InChIKeyAYHQYINAUHMOPU-UHFFFAOYSA-N
XLogP5.02
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms28
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500371.52
LogP ≤ 55.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,1,3-triphenyl-2-piperidin-1-ylpropan-1-ol?
The IUPAC name of 1,1,3-triphenyl-2-piperidin-1-ylpropan-1-ol (CID 23250666) is 1,1,3-triphenyl-2-piperidin-1-ylpropan-1-ol.
What is the SMILES notation for 1,1,3-triphenyl-2-piperidin-1-ylpropan-1-ol?
The canonical SMILES for 1,1,3-triphenyl-2-piperidin-1-ylpropan-1-ol is OC(c1ccccc1)(c1ccccc1)C(Cc1ccccc1)N1CCCCC1.
What is the InChIKey of 1,1,3-triphenyl-2-piperidin-1-ylpropan-1-ol?
The InChIKey is AYHQYINAUHMOPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H29NO/c28-26(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25(27-19-11-4-12-20-27)21-22-13-5-1-6-14-22/h1-3,5-10,13-18,25,28H,4,11-12,19-21H2.
What are the key properties of 1,1,3-triphenyl-2-piperidin-1-ylpropan-1-ol?
1,1,3-triphenyl-2-piperidin-1-ylpropan-1-ol has a molecular weight of 371.52 g/mol, XLogP of 5.02, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,3-triphenyl-2-piperidin-1-ylpropan-1-ol is sourced from PubChem (CID 23250666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).