6-[(3-methoxypiperidin-1-yl)methyl]-2-methylquinoline

C17H22N2O — CID 126778484

IUPAC6-[(3-methoxypiperidin-1-yl)methyl]-2-methylquinoline
SMILESCOC1CCCN(Cc2ccc3nc(C)ccc3c2)C1
InChIInChI=1S/C17H22N2O/c1-13-5-7-15-10-14(6-8-17(15)18-13)11-19-9-3-4-16(12-19)20-2/h5-8,10,16H,3-4,9,11-12H2,1-2H3
InChIKeyYFIYUYZDWMNGDO-UHFFFAOYSA-N
MW270.38 g/mol
LogP3.15
Rot. Bonds3

About 6-[(3-methoxypiperidin-1-yl)methyl]-2-methylquinoline

6-[(3-methoxypiperidin-1-yl)methyl]-2-methylquinoline (PubChem CID 126778484) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is 6-[(3-methoxypiperidin-1-yl)methyl]-2-methylquinoline.

Molecular Properties

Compound Name6-[(3-methoxypiperidin-1-yl)methyl]-2-methylquinoline
PubChem CID126778484
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC Name6-[(3-methoxypiperidin-1-yl)methyl]-2-methylquinoline
SMILESCOC1CCCN(Cc2ccc3nc(C)ccc3c2)C1
InChIInChI=1S/C17H22N2O/c1-13-5-7-15-10-14(6-8-17(15)18-13)11-19-9-3-4-16(12-19)20-2/h5-8,10,16H,3-4,9,11-12H2,1-2H3
InChIKeyYFIYUYZDWMNGDO-UHFFFAOYSA-N
XLogP3.15
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-[(2-methylquinolin-6-yl)methyl]piperidin-3-amine
CID 105378976
2-methyl-6-[(3-methylpyrrolidin-1-yl)methyl]quinoline
CID 170707754
2-methyl-6-[(3-methylpiperazin-1-yl)methyl]quinoline
CID 105379000
1-[1-[(2-methylquinolin-6-yl)methyl]piperidin-3-yl]piperazin-2-one
CID 120844613
N-(cyclopropylmethyl)-1-[(2-methylquinolin-6-yl)methyl]piperidin-4-amine;hydrochloride
CID 120841570
4-[(3-methoxypiperidin-1-yl)methyl]pyridine
CID 131702809
1-[(4-iodophenyl)methyl]-3-methoxypiperidine
CID 103713929
[(2S,4R)-4-methoxy-1-[(2-methylquinolin-6-yl)methyl]pyrrolidin-2-yl]methanol
CID 128979762
[3-[(3-methoxypiperidin-1-yl)methyl]phenyl]methanamine
CID 102956590
[1-[(2-methylquinolin-6-yl)methyl]pyrrolidin-2-yl]methanamine;hydrochloride
CID 120841918
4-methyl-1-[(2-methylquinolin-6-yl)methyl]pyrrolidin-3-amine;hydrochloride
CID 120909674
2-fluoro-5-[(3-methoxypiperidin-1-yl)methyl]benzoic acid
CID 107880927

Frequently Asked Questions

What is the IUPAC name of 6-[(3-methoxypiperidin-1-yl)methyl]-2-methylquinoline?
The IUPAC name of 6-[(3-methoxypiperidin-1-yl)methyl]-2-methylquinoline (CID 126778484) is 6-[(3-methoxypiperidin-1-yl)methyl]-2-methylquinoline.
What is the SMILES notation for 6-[(3-methoxypiperidin-1-yl)methyl]-2-methylquinoline?
The canonical SMILES for 6-[(3-methoxypiperidin-1-yl)methyl]-2-methylquinoline is COC1CCCN(Cc2ccc3nc(C)ccc3c2)C1.
What is the InChIKey of 6-[(3-methoxypiperidin-1-yl)methyl]-2-methylquinoline?
The InChIKey is YFIYUYZDWMNGDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-13-5-7-15-10-14(6-8-17(15)18-13)11-19-9-3-4-16(12-19)20-2/h5-8,10,16H,3-4,9,11-12H2,1-2H3.
What are the key properties of 6-[(3-methoxypiperidin-1-yl)methyl]-2-methylquinoline?
6-[(3-methoxypiperidin-1-yl)methyl]-2-methylquinoline has a molecular weight of 270.38 g/mol, XLogP of 3.15, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(3-methoxypiperidin-1-yl)methyl]-2-methylquinoline is sourced from PubChem (CID 126778484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).