2-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]quinoline

C20H21N3O — CID 133349552

IUPAC2-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]quinoline
SMILESc1ccc(OCC2CCN(c3ccc4ccccc4n3)CC2)nc1
InChIInChI=1S/C20H21N3O/c1-2-6-18-17(5-1)8-9-19(22-18)23-13-10-16(11-14-23)15-24-20-7-3-4-12-21-20/h1-9,12,16H,10-11,13-15H2
InChIKeyIHYFLJDVADRFEO-UHFFFAOYSA-N
MW319.41 g/mol
LogP3.93
Rot. Bonds4

About 2-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]quinoline

2-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]quinoline (PubChem CID 133349552) has the molecular formula C20H21N3O and a molecular weight of 319.41 g/mol. Its IUPAC name is 2-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]quinoline.

Molecular Properties

Compound Name2-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]quinoline
PubChem CID133349552
Molecular FormulaC20H21N3O
Molecular Weight319.41 g/mol
Exact Mass319.17
IUPAC Name2-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]quinoline
SMILESc1ccc(OCC2CCN(c3ccc4ccccc4n3)CC2)nc1
InChIInChI=1S/C20H21N3O/c1-2-6-18-17(5-1)8-9-19(22-18)23-13-10-16(11-14-23)15-24-20-7-3-4-12-21-20/h1-9,12,16H,10-11,13-15H2
InChIKeyIHYFLJDVADRFEO-UHFFFAOYSA-N
XLogP3.93
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.41
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrido[2,3-b]pyrazine
CID 126874369
2-fluoro-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyridine
CID 133349592
2-methylsulfanyl-4-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrimidine
CID 166605956
4-methoxy-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrimidine
CID 166605974
2-methyl-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrazine
CID 126874169
3-methylsulfanyl-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyridazine
CID 133349542
3-methyl-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrimidin-4-one
CID 126874409
N-(cyclopropylmethyl)-1-quinolin-2-ylpiperidin-4-amine
CID 115307554
5-piperidin-1-ylsulfonyl-2-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyridine
CID 133349588
2-(4-pyrimidin-2-ylpiperazin-1-yl)quinoline
CID 7033665
2-methyl-1-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]propan-2-ol
CID 111543946
2-[4-[(3-bromo-2-pyridinyl)oxy]piperidin-1-yl]quinoline
CID 58547880

Frequently Asked Questions

What is the IUPAC name of 2-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]quinoline?
The IUPAC name of 2-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]quinoline (CID 133349552) is 2-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]quinoline.
What is the SMILES notation for 2-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]quinoline?
The canonical SMILES for 2-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]quinoline is c1ccc(OCC2CCN(c3ccc4ccccc4n3)CC2)nc1.
What is the InChIKey of 2-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]quinoline?
The InChIKey is IHYFLJDVADRFEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O/c1-2-6-18-17(5-1)8-9-19(22-18)23-13-10-16(11-14-23)15-24-20-7-3-4-12-21-20/h1-9,12,16H,10-11,13-15H2.
What are the key properties of 2-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]quinoline?
2-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]quinoline has a molecular weight of 319.41 g/mol, XLogP of 3.93, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]quinoline is sourced from PubChem (CID 133349552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).