5-[(1-methylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline

C16H24N2O — CID 115075173

IUPAC5-[(1-methylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline
SMILESCN1CCCC(COc2cccc3c2CCCN3)C1
InChIInChI=1S/C16H24N2O/c1-18-10-4-5-13(11-18)12-19-16-8-2-7-15-14(16)6-3-9-17-15/h2,7-8,13,17H,3-6,9-12H2,1H3
InChIKeyKYONZAKRKCJPOI-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.77
Rot. Bonds3

About 5-[(1-methylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline

5-[(1-methylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline (PubChem CID 115075173) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 5-[(1-methylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name5-[(1-methylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline
PubChem CID115075173
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name5-[(1-methylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline
SMILESCN1CCCC(COc2cccc3c2CCCN3)C1
InChIInChI=1S/C16H24N2O/c1-18-10-4-5-13(11-18)12-19-16-8-2-7-15-14(16)6-3-9-17-15/h2,7-8,13,17H,3-6,9-12H2,1H3
InChIKeyKYONZAKRKCJPOI-UHFFFAOYSA-N
XLogP2.77
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(1-methylpiperidin-4-yl)methoxy]-1,2,3,4-tetrahydroquinoline
CID 115075157
8-[(1-methylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline
CID 115075706
5-[(3-methylcyclopentyl)methoxy]-1,2,3,4-tetrahydroquinoline
CID 115075113
5-[(1-propan-2-ylpiperidin-2-yl)methoxy]-1,2,3,4-tetrahydroquinoline
CID 115075088
5-[(1,4-dimethylpiperidin-4-yl)methoxy]-1,2,3,4-tetrahydroquinoline
CID 115075159
5-(3-methylbutoxy)-1,2,3,4-tetrahydroquinoline
CID 103045046
5-(3-piperidin-1-ylpropoxy)-1,2,3,4-tetrahydroquinoline
CID 10358078
5-methoxy-1,2,3,4-tetrahydroquinoline;dihydrochloride
CID 133058760
5-(2-bicyclo[2.2.1]heptanylmethoxy)-1,2,3,4-tetrahydroquinoline
CID 103044970
5-[2-(3-methoxypropoxy)ethoxy]-1,2,3,4-tetrahydroquinoline
CID 103180421
2-(1,2,3,4-tetrahydroquinolin-5-yloxy)ethanamine
CID 84664284
N-[(1-methylpyrrolidin-3-yl)methyl]-1,2,3,4-tetrahydroquinoline-5-sulfonamide
CID 104773789

Frequently Asked Questions

What is the IUPAC name of 5-[(1-methylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 5-[(1-methylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline (CID 115075173) is 5-[(1-methylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 5-[(1-methylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 5-[(1-methylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline is CN1CCCC(COc2cccc3c2CCCN3)C1.
What is the InChIKey of 5-[(1-methylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline?
The InChIKey is KYONZAKRKCJPOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-18-10-4-5-13(11-18)12-19-16-8-2-7-15-14(16)6-3-9-17-15/h2,7-8,13,17H,3-6,9-12H2,1H3.
What are the key properties of 5-[(1-methylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline?
5-[(1-methylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline has a molecular weight of 260.38 g/mol, XLogP of 2.77, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(1-methylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 115075173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).