4-(4-chlorophenyl)-1-(3-phenylpropyl)piperidin-4-ol

C20H24ClNO — CID 10892851

IUPAC4-(4-chlorophenyl)-1-(3-phenylpropyl)piperidin-4-ol
SMILESOC1(c2ccc(Cl)cc2)CCN(CCCc2ccccc2)CC1
InChIInChI=1S/C20H24ClNO/c21-19-10-8-18(9-11-19)20(23)12-15-22(16-13-20)14-4-7-17-5-2-1-3-6-17/h1-3,5-6,8-11,23H,4,7,12-16H2
InChIKeyWFQAUBWSHNCWHT-UHFFFAOYSA-N
MW329.87 g/mol
LogP4.26
Rot. Bonds5

About 4-(4-chlorophenyl)-1-(3-phenylpropyl)piperidin-4-ol

4-(4-chlorophenyl)-1-(3-phenylpropyl)piperidin-4-ol (PubChem CID 10892851) has the molecular formula C20H24ClNO and a molecular weight of 329.87 g/mol. Its IUPAC name is 4-(4-chlorophenyl)-1-(3-phenylpropyl)piperidin-4-ol.

Molecular Properties

Compound Name4-(4-chlorophenyl)-1-(3-phenylpropyl)piperidin-4-ol
PubChem CID10892851
Molecular FormulaC20H24ClNO
Molecular Weight329.87 g/mol
Exact Mass329.15
IUPAC Name4-(4-chlorophenyl)-1-(3-phenylpropyl)piperidin-4-ol
SMILESOC1(c2ccc(Cl)cc2)CCN(CCCc2ccccc2)CC1
InChIInChI=1S/C20H24ClNO/c21-19-10-8-18(9-11-19)20(23)12-15-22(16-13-20)14-4-7-17-5-2-1-3-6-17/h1-3,5-6,8-11,23H,4,7,12-16H2
InChIKeyWFQAUBWSHNCWHT-UHFFFAOYSA-N
XLogP4.26
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.87
LogP ≤ 54.26
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-phenylpropyl)piperidin-4-ol?
The IUPAC name of 4-(4-chlorophenyl)-1-(3-phenylpropyl)piperidin-4-ol (CID 10892851) is 4-(4-chlorophenyl)-1-(3-phenylpropyl)piperidin-4-ol.
What is the SMILES notation for 4-(4-chlorophenyl)-1-(3-phenylpropyl)piperidin-4-ol?
The canonical SMILES for 4-(4-chlorophenyl)-1-(3-phenylpropyl)piperidin-4-ol is OC1(c2ccc(Cl)cc2)CCN(CCCc2ccccc2)CC1.
What is the InChIKey of 4-(4-chlorophenyl)-1-(3-phenylpropyl)piperidin-4-ol?
The InChIKey is WFQAUBWSHNCWHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24ClNO/c21-19-10-8-18(9-11-19)20(23)12-15-22(16-13-20)14-4-7-17-5-2-1-3-6-17/h1-3,5-6,8-11,23H,4,7,12-16H2.
What are the key properties of 4-(4-chlorophenyl)-1-(3-phenylpropyl)piperidin-4-ol?
4-(4-chlorophenyl)-1-(3-phenylpropyl)piperidin-4-ol has a molecular weight of 329.87 g/mol, XLogP of 4.26, 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-phenylpropyl)piperidin-4-ol is sourced from PubChem (CID 10892851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).