8-[(5,5-dimethyloxolan-2-yl)methoxy]-1,2,3,4-tetrahydroquinoline

C16H23NO2 — CID 116522225

IUPAC8-[(5,5-dimethyloxolan-2-yl)methoxy]-1,2,3,4-tetrahydroquinoline
SMILESCC1(C)CCC(COc2cccc3c2NCCC3)O1
InChIInChI=1S/C16H23NO2/c1-16(2)9-8-13(19-16)11-18-14-7-3-5-12-6-4-10-17-15(12)14/h3,5,7,13,17H,4,6,8-11H2,1-2H3
InChIKeyUWTUIMCFFHYLPC-UHFFFAOYSA-N
MW261.36 g/mol
LogP3.38
Rot. Bonds3

About 8-[(5,5-dimethyloxolan-2-yl)methoxy]-1,2,3,4-tetrahydroquinoline

8-[(5,5-dimethyloxolan-2-yl)methoxy]-1,2,3,4-tetrahydroquinoline (PubChem CID 116522225) has the molecular formula C16H23NO2 and a molecular weight of 261.36 g/mol. Its IUPAC name is 8-[(5,5-dimethyloxolan-2-yl)methoxy]-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name8-[(5,5-dimethyloxolan-2-yl)methoxy]-1,2,3,4-tetrahydroquinoline
PubChem CID116522225
Molecular FormulaC16H23NO2
Molecular Weight261.36 g/mol
Exact Mass261.17
IUPAC Name8-[(5,5-dimethyloxolan-2-yl)methoxy]-1,2,3,4-tetrahydroquinoline
SMILESCC1(C)CCC(COc2cccc3c2NCCC3)O1
InChIInChI=1S/C16H23NO2/c1-16(2)9-8-13(19-16)11-18-14-7-3-5-12-6-4-10-17-15(12)14/h3,5,7,13,17H,4,6,8-11H2,1-2H3
InChIKeyUWTUIMCFFHYLPC-UHFFFAOYSA-N
XLogP3.38
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.36
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,2-dimethyl-5-(naphthalen-1-yloxymethyl)oxolane
CID 116524402
8-[(1-methylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline
CID 115075706
8-[(2-methyloxan-2-yl)methoxy]-1,2,3,4-tetrahydroquinoline
CID 115075614
8-[(1-ethylpiperidin-4-yl)methoxy]-1,2,3,4-tetrahydroquinoline
CID 115075693
[2-[(5,5-dimethyloxolan-2-yl)methoxy]phenyl]-trifluoroboranuide
CID 116522447
8-(3,3-dimethylcyclopentyl)oxy-1,2,3,4-tetrahydroquinoline
CID 115075643
8-(3,3-dimethylcyclohexyl)oxy-1,2,3,4-tetrahydroquinoline
CID 115075697
[2-chloro-6-[(5,5-dimethyloxolan-2-yl)methoxy]phenyl]methanamine
CID 116520606
8-(2,3-dihydro-1-benzofuran-3-ylmethoxy)-1,2,3,4-tetrahydroquinoline
CID 79219091
8-[(1,3-dimethylpyrrolidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline
CID 115075679
8-(2-fluoro-2-methylpropoxy)-1,2,3,4-tetrahydroquinoline
CID 115075715
(5S)-2,2-dimethyl-5-(phenoxymethyl)oxolane
CID 141293396

Frequently Asked Questions

What is the IUPAC name of 8-[(5,5-dimethyloxolan-2-yl)methoxy]-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 8-[(5,5-dimethyloxolan-2-yl)methoxy]-1,2,3,4-tetrahydroquinoline (CID 116522225) is 8-[(5,5-dimethyloxolan-2-yl)methoxy]-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 8-[(5,5-dimethyloxolan-2-yl)methoxy]-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 8-[(5,5-dimethyloxolan-2-yl)methoxy]-1,2,3,4-tetrahydroquinoline is CC1(C)CCC(COc2cccc3c2NCCC3)O1.
What is the InChIKey of 8-[(5,5-dimethyloxolan-2-yl)methoxy]-1,2,3,4-tetrahydroquinoline?
The InChIKey is UWTUIMCFFHYLPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO2/c1-16(2)9-8-13(19-16)11-18-14-7-3-5-12-6-4-10-17-15(12)14/h3,5,7,13,17H,4,6,8-11H2,1-2H3.
What are the key properties of 8-[(5,5-dimethyloxolan-2-yl)methoxy]-1,2,3,4-tetrahydroquinoline?
8-[(5,5-dimethyloxolan-2-yl)methoxy]-1,2,3,4-tetrahydroquinoline has a molecular weight of 261.36 g/mol, XLogP of 3.38, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(5,5-dimethyloxolan-2-yl)methoxy]-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 116522225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).