3-cyclopentyl-6,7-dimethoxyquinoline

C16H19NO2 — CID 10422592

IUPAC3-cyclopentyl-6,7-dimethoxyquinoline
SMILESCOc1cc2cc(C3CCCC3)cnc2cc1OC
InChIInChI=1S/C16H19NO2/c1-18-15-8-12-7-13(11-5-3-4-6-11)10-17-14(12)9-16(15)19-2/h7-11H,3-6H2,1-2H3
InChIKeyBYQWDMZNUPGMNG-UHFFFAOYSA-N
MW257.33 g/mol
LogP3.91
Rot. Bonds3

About 3-cyclopentyl-6,7-dimethoxyquinoline

3-cyclopentyl-6,7-dimethoxyquinoline (PubChem CID 10422592) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is 3-cyclopentyl-6,7-dimethoxyquinoline.

Molecular Properties

Compound Name3-cyclopentyl-6,7-dimethoxyquinoline
PubChem CID10422592
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC Name3-cyclopentyl-6,7-dimethoxyquinoline
SMILESCOc1cc2cc(C3CCCC3)cnc2cc1OC
InChIInChI=1S/C16H19NO2/c1-18-15-8-12-7-13(11-5-3-4-6-11)10-17-14(12)9-16(15)19-2/h7-11H,3-6H2,1-2H3
InChIKeyBYQWDMZNUPGMNG-UHFFFAOYSA-N
XLogP3.91
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Papaverine
CID 4680
Papaverine Hydrochloride
CID 6084
Sitamaquine
CID 42548
Ethaverine
CID 3280
Ethaverine Hydrochloride
CID 5702159
Palmatine
CID 19009
Palmatine Chloride
CID 73442
Coralyne chloride
CID 23306
6,7-Dimethoxy-3-phenylquinoxaline
CID 2049
2,3,9,10-Tetramethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium;chloride;hydrate
CID 16212317
6-Methoxyquinoline
CID 14860
6,7-Dimethoxy-1-methylisoquinoline
CID 20725

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-6,7-dimethoxyquinoline?
The IUPAC name of 3-cyclopentyl-6,7-dimethoxyquinoline (CID 10422592) is 3-cyclopentyl-6,7-dimethoxyquinoline.
What is the SMILES notation for 3-cyclopentyl-6,7-dimethoxyquinoline?
The canonical SMILES for 3-cyclopentyl-6,7-dimethoxyquinoline is COc1cc2cc(C3CCCC3)cnc2cc1OC.
What is the InChIKey of 3-cyclopentyl-6,7-dimethoxyquinoline?
The InChIKey is BYQWDMZNUPGMNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-18-15-8-12-7-13(11-5-3-4-6-11)10-17-14(12)9-16(15)19-2/h7-11H,3-6H2,1-2H3.
What are the key properties of 3-cyclopentyl-6,7-dimethoxyquinoline?
3-cyclopentyl-6,7-dimethoxyquinoline has a molecular weight of 257.33 g/mol, XLogP of 3.91, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-6,7-dimethoxyquinoline is sourced from PubChem (CID 10422592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).