4-methyl-2-(2-piperidin-1-ylethoxy)quinoline;hydrochloride

C17H23ClN2O — CID 6602778

IUPAC4-methyl-2-(2-piperidin-1-ylethoxy)quinoline;hydrochloride
SMILESCc1cc(OCCN2CCCCC2)nc2ccccc12.Cl
InChIInChI=1S/C17H22N2O.ClH/c1-14-13-17(18-16-8-4-3-7-15(14)16)20-12-11-19-9-5-2-6-10-19;/h3-4,7-8,13H,2,5-6,9-12H2,1H3;1H
InChIKeyMZLHWLLOTYKOGZ-UHFFFAOYSA-N
MW306.84 g/mol
LogP3.83
Rot. Bonds4

About 4-methyl-2-(2-piperidin-1-ylethoxy)quinoline;hydrochloride

4-methyl-2-(2-piperidin-1-ylethoxy)quinoline;hydrochloride (PubChem CID 6602778) has the molecular formula C17H23ClN2O and a molecular weight of 306.84 g/mol. Its IUPAC name is 4-methyl-2-(2-piperidin-1-ylethoxy)quinoline;hydrochloride.

Molecular Properties

Compound Name4-methyl-2-(2-piperidin-1-ylethoxy)quinoline;hydrochloride
PubChem CID6602778
Molecular FormulaC17H23ClN2O
Molecular Weight306.84 g/mol
Exact Mass306.15
IUPAC Name4-methyl-2-(2-piperidin-1-ylethoxy)quinoline;hydrochloride
SMILESCc1cc(OCCN2CCCCC2)nc2ccccc12.Cl
InChIInChI=1S/C17H22N2O.ClH/c1-14-13-17(18-16-8-4-3-7-15(14)16)20-12-11-19-9-5-2-6-10-19;/h3-4,7-8,13H,2,5-6,9-12H2,1H3;1H
InChIKeyMZLHWLLOTYKOGZ-UHFFFAOYSA-N
XLogP3.83
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.84
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(2-piperidin-1-ylethoxy)quinoline;hydrochloride?
The IUPAC name of 4-methyl-2-(2-piperidin-1-ylethoxy)quinoline;hydrochloride (CID 6602778) is 4-methyl-2-(2-piperidin-1-ylethoxy)quinoline;hydrochloride.
What is the SMILES notation for 4-methyl-2-(2-piperidin-1-ylethoxy)quinoline;hydrochloride?
The canonical SMILES for 4-methyl-2-(2-piperidin-1-ylethoxy)quinoline;hydrochloride is Cc1cc(OCCN2CCCCC2)nc2ccccc12.Cl.
What is the InChIKey of 4-methyl-2-(2-piperidin-1-ylethoxy)quinoline;hydrochloride?
The InChIKey is MZLHWLLOTYKOGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O.ClH/c1-14-13-17(18-16-8-4-3-7-15(14)16)20-12-11-19-9-5-2-6-10-19;/h3-4,7-8,13H,2,5-6,9-12H2,1H3;1H.
What are the key properties of 4-methyl-2-(2-piperidin-1-ylethoxy)quinoline;hydrochloride?
4-methyl-2-(2-piperidin-1-ylethoxy)quinoline;hydrochloride has a molecular weight of 306.84 g/mol, XLogP of 3.83, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(2-piperidin-1-ylethoxy)quinoline;hydrochloride is sourced from PubChem (CID 6602778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).