8-(piperidin-2-ylmethoxymethyl)quinoline

C16H20N2O — CID 62341251

IUPAC8-(piperidin-2-ylmethoxymethyl)quinoline
SMILESc1cnc2c(COCC3CCCCN3)cccc2c1
InChIInChI=1S/C16H20N2O/c1-2-9-17-15(8-1)12-19-11-14-6-3-5-13-7-4-10-18-16(13)14/h3-7,10,15,17H,1-2,8-9,11-12H2
InChIKeySOECARXWMPLLIK-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.89
Rot. Bonds4

About 8-(piperidin-2-ylmethoxymethyl)quinoline

8-(piperidin-2-ylmethoxymethyl)quinoline (PubChem CID 62341251) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is 8-(piperidin-2-ylmethoxymethyl)quinoline.

Molecular Properties

Compound Name8-(piperidin-2-ylmethoxymethyl)quinoline
PubChem CID62341251
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name8-(piperidin-2-ylmethoxymethyl)quinoline
SMILESc1cnc2c(COCC3CCCCN3)cccc2c1
InChIInChI=1S/C16H20N2O/c1-2-9-17-15(8-1)12-19-11-14-6-3-5-13-7-4-10-18-16(13)14/h3-7,10,15,17H,1-2,8-9,11-12H2
InChIKeySOECARXWMPLLIK-UHFFFAOYSA-N
XLogP2.89
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-(piperidin-2-ylmethoxymethyl)quinoline?
The IUPAC name of 8-(piperidin-2-ylmethoxymethyl)quinoline (CID 62341251) is 8-(piperidin-2-ylmethoxymethyl)quinoline.
What is the SMILES notation for 8-(piperidin-2-ylmethoxymethyl)quinoline?
The canonical SMILES for 8-(piperidin-2-ylmethoxymethyl)quinoline is c1cnc2c(COCC3CCCCN3)cccc2c1.
What is the InChIKey of 8-(piperidin-2-ylmethoxymethyl)quinoline?
The InChIKey is SOECARXWMPLLIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-2-9-17-15(8-1)12-19-11-14-6-3-5-13-7-4-10-18-16(13)14/h3-7,10,15,17H,1-2,8-9,11-12H2.
What are the key properties of 8-(piperidin-2-ylmethoxymethyl)quinoline?
8-(piperidin-2-ylmethoxymethyl)quinoline has a molecular weight of 256.35 g/mol, XLogP of 2.89, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(piperidin-2-ylmethoxymethyl)quinoline is sourced from PubChem (CID 62341251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).