3-(2-methylquinolin-8-yl)oxypentan-1-amine

C15H20N2O — CID 43175250

IUPAC3-(2-methylquinolin-8-yl)oxypentan-1-amine
SMILESCCC(CCN)Oc1cccc2ccc(C)nc12
InChIInChI=1S/C15H20N2O/c1-3-13(9-10-16)18-14-6-4-5-12-8-7-11(2)17-15(12)14/h4-8,13H,3,9-10,16H2,1-2H3
InChIKeyGPEJGHIJBUDBAH-UHFFFAOYSA-N
MW244.34 g/mol
LogP3.05
Rot. Bonds5

About 3-(2-methylquinolin-8-yl)oxypentan-1-amine

3-(2-methylquinolin-8-yl)oxypentan-1-amine (PubChem CID 43175250) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 3-(2-methylquinolin-8-yl)oxypentan-1-amine.

Molecular Properties

Compound Name3-(2-methylquinolin-8-yl)oxypentan-1-amine
PubChem CID43175250
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name3-(2-methylquinolin-8-yl)oxypentan-1-amine
SMILESCCC(CCN)Oc1cccc2ccc(C)nc12
InChIInChI=1S/C15H20N2O/c1-3-13(9-10-16)18-14-6-4-5-12-8-7-11(2)17-15(12)14/h4-8,13H,3,9-10,16H2,1-2H3
InChIKeyGPEJGHIJBUDBAH-UHFFFAOYSA-N
XLogP3.05
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methylquinolin-8-yl)oxypentan-1-amine?
The IUPAC name of 3-(2-methylquinolin-8-yl)oxypentan-1-amine (CID 43175250) is 3-(2-methylquinolin-8-yl)oxypentan-1-amine.
What is the SMILES notation for 3-(2-methylquinolin-8-yl)oxypentan-1-amine?
The canonical SMILES for 3-(2-methylquinolin-8-yl)oxypentan-1-amine is CCC(CCN)Oc1cccc2ccc(C)nc12.
What is the InChIKey of 3-(2-methylquinolin-8-yl)oxypentan-1-amine?
The InChIKey is GPEJGHIJBUDBAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-3-13(9-10-16)18-14-6-4-5-12-8-7-11(2)17-15(12)14/h4-8,13H,3,9-10,16H2,1-2H3.
What are the key properties of 3-(2-methylquinolin-8-yl)oxypentan-1-amine?
3-(2-methylquinolin-8-yl)oxypentan-1-amine has a molecular weight of 244.34 g/mol, XLogP of 3.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylquinolin-8-yl)oxypentan-1-amine is sourced from PubChem (CID 43175250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).