2-[1-(6-methoxyquinolin-2-yl)piperidin-3-yl]oxyethanol

C17H22N2O3 — CID 133315183

IUPAC2-[1-(6-methoxyquinolin-2-yl)piperidin-3-yl]oxyethanol
SMILESCOc1ccc2nc(N3CCCC(OCCO)C3)ccc2c1
InChIInChI=1S/C17H22N2O3/c1-21-14-5-6-16-13(11-14)4-7-17(18-16)19-8-2-3-15(12-19)22-10-9-20/h4-7,11,15,20H,2-3,8-10,12H2,1H3
InChIKeyMVADHWJPVUAOCM-UHFFFAOYSA-N
MW302.37 g/mol
LogP2.22
Rot. Bonds5

About 2-[1-(6-methoxyquinolin-2-yl)piperidin-3-yl]oxyethanol

2-[1-(6-methoxyquinolin-2-yl)piperidin-3-yl]oxyethanol (PubChem CID 133315183) has the molecular formula C17H22N2O3 and a molecular weight of 302.37 g/mol. Its IUPAC name is 2-[1-(6-methoxyquinolin-2-yl)piperidin-3-yl]oxyethanol.

Molecular Properties

Compound Name2-[1-(6-methoxyquinolin-2-yl)piperidin-3-yl]oxyethanol
PubChem CID133315183
Molecular FormulaC17H22N2O3
Molecular Weight302.37 g/mol
Exact Mass302.16
IUPAC Name2-[1-(6-methoxyquinolin-2-yl)piperidin-3-yl]oxyethanol
SMILESCOc1ccc2nc(N3CCCC(OCCO)C3)ccc2c1
InChIInChI=1S/C17H22N2O3/c1-21-14-5-6-16-13(11-14)4-7-17(18-16)19-8-2-3-15(12-19)22-10-9-20/h4-7,11,15,20H,2-3,8-10,12H2,1H3
InChIKeyMVADHWJPVUAOCM-UHFFFAOYSA-N
XLogP2.22
TPSA54.82 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.37
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[1-(6-methoxyquinolin-2-yl)piperidin-3-yl]oxyethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[1-(6-nitroquinolin-2-yl)piperidin-3-yl]oxyethanol
CID 133315162
6-methoxy-2-piperidin-1-ylquinoline
CID 143398989
N-[1-(6-methoxyquinolin-2-yl)piperidin-3-yl]methanesulfonamide
CID 163354804
2-[1-[3-(hydroxymethyl)quinolin-2-yl]piperidin-3-yl]oxyethanol
CID 75421713
2-(4-cyclopropylpiperazin-1-yl)-6-methoxyquinoline;dihydrochloride
CID 11302721
ethyl 1-(6-methoxyquinolin-2-yl)piperidine-4-carboxylate
CID 141431671
2-[1-(6-chloropyrazin-2-yl)piperidin-3-yl]oxyethanol
CID 133315157
2-[1-(3-ethyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperidin-3-yl]oxyethanol
CID 133315311
N-cyclopropyl-1-(6-methoxyquinolin-2-yl)azetidine-3-carboxamide
CID 171328605
N-cyclobutyl-2-[1-(6-methoxyquinolin-2-yl)piperidin-4-yl]acetamide
CID 172881536
2-[(3S)-1-(1H-benzimidazol-2-yl)piperidin-3-yl]oxyethanol
CID 99776526
2-(1-pyrimidin-2-ylpiperidin-3-yl)oxyethanol
CID 133315289

Frequently Asked Questions

What is the IUPAC name of 2-[1-(6-methoxyquinolin-2-yl)piperidin-3-yl]oxyethanol?
The IUPAC name of 2-[1-(6-methoxyquinolin-2-yl)piperidin-3-yl]oxyethanol (CID 133315183) is 2-[1-(6-methoxyquinolin-2-yl)piperidin-3-yl]oxyethanol.
What is the SMILES notation for 2-[1-(6-methoxyquinolin-2-yl)piperidin-3-yl]oxyethanol?
The canonical SMILES for 2-[1-(6-methoxyquinolin-2-yl)piperidin-3-yl]oxyethanol is COc1ccc2nc(N3CCCC(OCCO)C3)ccc2c1.
What is the InChIKey of 2-[1-(6-methoxyquinolin-2-yl)piperidin-3-yl]oxyethanol?
The InChIKey is MVADHWJPVUAOCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O3/c1-21-14-5-6-16-13(11-14)4-7-17(18-16)19-8-2-3-15(12-19)22-10-9-20/h4-7,11,15,20H,2-3,8-10,12H2,1H3.
What are the key properties of 2-[1-(6-methoxyquinolin-2-yl)piperidin-3-yl]oxyethanol?
2-[1-(6-methoxyquinolin-2-yl)piperidin-3-yl]oxyethanol has a molecular weight of 302.37 g/mol, XLogP of 2.22, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(6-methoxyquinolin-2-yl)piperidin-3-yl]oxyethanol is sourced from PubChem (CID 133315183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).