3-quinolin-6-ylpiperidin-3-ol

C14H16N2O — CID 81216403

IUPAC3-quinolin-6-ylpiperidin-3-ol
SMILESOC1(c2ccc3ncccc3c2)CCCNC1
InChIInChI=1S/C14H16N2O/c17-14(6-2-7-15-10-14)12-4-5-13-11(9-12)3-1-8-16-13/h1,3-5,8-9,15,17H,2,6-7,10H2
InChIKeyQNJCCARQNGBLNI-UHFFFAOYSA-N
MW228.30 g/mol
LogP1.81
Rot. Bonds1

About 3-quinolin-6-ylpiperidin-3-ol

3-quinolin-6-ylpiperidin-3-ol (PubChem CID 81216403) has the molecular formula C14H16N2O and a molecular weight of 228.30 g/mol. Its IUPAC name is 3-quinolin-6-ylpiperidin-3-ol.

Molecular Properties

Compound Name3-quinolin-6-ylpiperidin-3-ol
PubChem CID81216403
Molecular FormulaC14H16N2O
Molecular Weight228.30 g/mol
Exact Mass228.13
IUPAC Name3-quinolin-6-ylpiperidin-3-ol
SMILESOC1(c2ccc3ncccc3c2)CCCNC1
InChIInChI=1S/C14H16N2O/c17-14(6-2-7-15-10-14)12-4-5-13-11(9-12)3-1-8-16-13/h1,3-5,8-9,15,17H,2,6-7,10H2
InChIKeyQNJCCARQNGBLNI-UHFFFAOYSA-N
XLogP1.81
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-quinolin-6-ylpiperidin-3-ol?
The IUPAC name of 3-quinolin-6-ylpiperidin-3-ol (CID 81216403) is 3-quinolin-6-ylpiperidin-3-ol.
What is the SMILES notation for 3-quinolin-6-ylpiperidin-3-ol?
The canonical SMILES for 3-quinolin-6-ylpiperidin-3-ol is OC1(c2ccc3ncccc3c2)CCCNC1.
What is the InChIKey of 3-quinolin-6-ylpiperidin-3-ol?
The InChIKey is QNJCCARQNGBLNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c17-14(6-2-7-15-10-14)12-4-5-13-11(9-12)3-1-8-16-13/h1,3-5,8-9,15,17H,2,6-7,10H2.
What are the key properties of 3-quinolin-6-ylpiperidin-3-ol?
3-quinolin-6-ylpiperidin-3-ol has a molecular weight of 228.30 g/mol, XLogP of 1.81, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-quinolin-6-ylpiperidin-3-ol is sourced from PubChem (CID 81216403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).