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

C16H23NO — CID 115075113

IUPAC5-[(3-methylcyclopentyl)methoxy]-1,2,3,4-tetrahydroquinoline
SMILESCC1CCC(COc2cccc3c2CCCN3)C1
InChIInChI=1S/C16H23NO/c1-12-7-8-13(10-12)11-18-16-6-2-5-15-14(16)4-3-9-17-15/h2,5-6,12-13,17H,3-4,7-11H2,1H3
InChIKeyGAQODEFSPVUACG-UHFFFAOYSA-N
MW245.37 g/mol
LogP3.86
Rot. Bonds3

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

5-[(3-methylcyclopentyl)methoxy]-1,2,3,4-tetrahydroquinoline (PubChem CID 115075113) has the molecular formula C16H23NO and a molecular weight of 245.37 g/mol. Its IUPAC name is 5-[(3-methylcyclopentyl)methoxy]-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name5-[(3-methylcyclopentyl)methoxy]-1,2,3,4-tetrahydroquinoline
PubChem CID115075113
Molecular FormulaC16H23NO
Molecular Weight245.37 g/mol
Exact Mass245.18
IUPAC Name5-[(3-methylcyclopentyl)methoxy]-1,2,3,4-tetrahydroquinoline
SMILESCC1CCC(COc2cccc3c2CCCN3)C1
InChIInChI=1S/C16H23NO/c1-12-7-8-13(10-12)11-18-16-6-2-5-15-14(16)4-3-9-17-15/h2,5-6,12-13,17H,3-4,7-11H2,1H3
InChIKeyGAQODEFSPVUACG-UHFFFAOYSA-N
XLogP3.86
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-[(1-methylpiperidin-4-yl)methoxy]-1,2,3,4-tetrahydroquinoline
CID 115075157
5-[(1-methylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline
CID 115075173
5-(2-bicyclo[2.2.1]heptanylmethoxy)-1,2,3,4-tetrahydroquinoline
CID 103044970
5-[(1-propan-2-ylpiperidin-2-yl)methoxy]-1,2,3,4-tetrahydroquinoline
CID 115075088
2-(1,2,3,4-tetrahydroquinolin-5-yloxy)ethanamine
CID 84664284
5-(2-fluoro-2-methylpropoxy)-1,2,3,4-tetrahydroquinoline
CID 115075184
5-(3-methylbutoxy)-1,2,3,4-tetrahydroquinoline
CID 103045046
4-(oxan-2-ylmethoxy)-2,3-dihydro-1H-indole
CID 115074354
5-[(1,4,4-trimethylcyclohexyl)methoxy]-1,2,3,4-tetrahydroquinoline
CID 115075120
4-(oxetan-3-ylmethoxy)-2,3-dihydro-1H-indole
CID 115074368
5-methoxy-1,2,3,4-tetrahydroquinoline;dihydrochloride
CID 133058760
5-[2-(3-methoxypropoxy)ethoxy]-1,2,3,4-tetrahydroquinoline
CID 103180421

Frequently Asked Questions

What is the IUPAC name of 5-[(3-methylcyclopentyl)methoxy]-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 5-[(3-methylcyclopentyl)methoxy]-1,2,3,4-tetrahydroquinoline (CID 115075113) is 5-[(3-methylcyclopentyl)methoxy]-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 5-[(3-methylcyclopentyl)methoxy]-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 5-[(3-methylcyclopentyl)methoxy]-1,2,3,4-tetrahydroquinoline is CC1CCC(COc2cccc3c2CCCN3)C1.
What is the InChIKey of 5-[(3-methylcyclopentyl)methoxy]-1,2,3,4-tetrahydroquinoline?
The InChIKey is GAQODEFSPVUACG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO/c1-12-7-8-13(10-12)11-18-16-6-2-5-15-14(16)4-3-9-17-15/h2,5-6,12-13,17H,3-4,7-11H2,1H3.
What are the key properties of 5-[(3-methylcyclopentyl)methoxy]-1,2,3,4-tetrahydroquinoline?
5-[(3-methylcyclopentyl)methoxy]-1,2,3,4-tetrahydroquinoline has a molecular weight of 245.37 g/mol, XLogP of 3.86, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3-methylcyclopentyl)methoxy]-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 115075113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).