2-(4-benzylpiperidin-1-yl)quinolin-8-ol

C21H22N2O — CID 16835893

IUPAC2-(4-benzylpiperidin-1-yl)quinolin-8-ol
SMILESOc1cccc2ccc(N3CCC(Cc4ccccc4)CC3)nc12
InChIInChI=1S/C21H22N2O/c24-19-8-4-7-18-9-10-20(22-21(18)19)23-13-11-17(12-14-23)15-16-5-2-1-3-6-16/h1-10,17,24H,11-15H2
InChIKeyKUYSWJINQATVSO-UHFFFAOYSA-N
MW318.42 g/mol
LogP4.40
Rot. Bonds3

About 2-(4-benzylpiperidin-1-yl)quinolin-8-ol

2-(4-benzylpiperidin-1-yl)quinolin-8-ol (PubChem CID 16835893) has the molecular formula C21H22N2O and a molecular weight of 318.42 g/mol. Its IUPAC name is 2-(4-benzylpiperidin-1-yl)quinolin-8-ol.

Molecular Properties

Compound Name2-(4-benzylpiperidin-1-yl)quinolin-8-ol
PubChem CID16835893
Molecular FormulaC21H22N2O
Molecular Weight318.42 g/mol
Exact Mass318.17
IUPAC Name2-(4-benzylpiperidin-1-yl)quinolin-8-ol
SMILESOc1cccc2ccc(N3CCC(Cc4ccccc4)CC3)nc12
InChIInChI=1S/C21H22N2O/c24-19-8-4-7-18-9-10-20(22-21(18)19)23-13-11-17(12-14-23)15-16-5-2-1-3-6-16/h1-10,17,24H,11-15H2
InChIKeyKUYSWJINQATVSO-UHFFFAOYSA-N
XLogP4.40
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-benzylpiperidin-1-yl)quinolin-8-ol?
The IUPAC name of 2-(4-benzylpiperidin-1-yl)quinolin-8-ol (CID 16835893) is 2-(4-benzylpiperidin-1-yl)quinolin-8-ol.
What is the SMILES notation for 2-(4-benzylpiperidin-1-yl)quinolin-8-ol?
The canonical SMILES for 2-(4-benzylpiperidin-1-yl)quinolin-8-ol is Oc1cccc2ccc(N3CCC(Cc4ccccc4)CC3)nc12.
What is the InChIKey of 2-(4-benzylpiperidin-1-yl)quinolin-8-ol?
The InChIKey is KUYSWJINQATVSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N2O/c24-19-8-4-7-18-9-10-20(22-21(18)19)23-13-11-17(12-14-23)15-16-5-2-1-3-6-16/h1-10,17,24H,11-15H2.
What are the key properties of 2-(4-benzylpiperidin-1-yl)quinolin-8-ol?
2-(4-benzylpiperidin-1-yl)quinolin-8-ol has a molecular weight of 318.42 g/mol, XLogP of 4.40, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-benzylpiperidin-1-yl)quinolin-8-ol is sourced from PubChem (CID 16835893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).