N-[2-(8-methoxyquinolin-2-yl)ethyl]propan-1-amine

C15H20N2O — CID 80703316

IUPACN-[2-(8-methoxyquinolin-2-yl)ethyl]propan-1-amine
SMILESCCCNCCc1ccc2cccc(OC)c2n1
InChIInChI=1S/C15H20N2O/c1-3-10-16-11-9-13-8-7-12-5-4-6-14(18-2)15(12)17-13/h4-8,16H,3,9-11H2,1-2H3
InChIKeyOMYKQLFKKIHABF-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.79
Rot. Bonds6

About N-[2-(8-methoxyquinolin-2-yl)ethyl]propan-1-amine

N-[2-(8-methoxyquinolin-2-yl)ethyl]propan-1-amine (PubChem CID 80703316) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is N-[2-(8-methoxyquinolin-2-yl)ethyl]propan-1-amine.

Molecular Properties

Compound NameN-[2-(8-methoxyquinolin-2-yl)ethyl]propan-1-amine
PubChem CID80703316
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC NameN-[2-(8-methoxyquinolin-2-yl)ethyl]propan-1-amine
SMILESCCCNCCc1ccc2cccc(OC)c2n1
InChIInChI=1S/C15H20N2O/c1-3-10-16-11-9-13-8-7-12-5-4-6-14(18-2)15(12)17-13/h4-8,16H,3,9-11H2,1-2H3
InChIKeyOMYKQLFKKIHABF-UHFFFAOYSA-N
XLogP2.79
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-methoxy-N-[(8-methoxyquinolin-2-yl)methyl]-2-methylpropan-1-amine
CID 104759612
N-[(8-methoxyquinolin-2-yl)methyl]-3-methylpentan-3-amine
CID 106328471
N-[(8-methoxyquinolin-2-yl)methyl]-2-methylbutan-1-amine
CID 80703435
N-[(8-methoxyquinolin-2-yl)methyl]-2-(1,2,4-oxadiazol-5-yl)ethanamine
CID 106395260
5-[(8-methoxyquinolin-2-yl)methylamino]pentan-1-ol
CID 107316801
2-(8-methoxyquinolin-2-yl)acetonitrile
CID 82241154
(2R)-1-(8-methoxyquinolin-2-yl)-N-methylpropan-2-amine
CID 59649232
2-[(8-methoxyquinolin-2-yl)methylamino]ethanesulfonamide
CID 80702043
1-methoxy-N-[(8-methoxyquinolin-2-yl)methyl]pentan-2-amine
CID 80703162
2-[2-[(8-methoxyquinolin-2-yl)methylamino]ethoxy]acetamide
CID 106236592
N-[(8-methoxyquinolin-2-yl)methyl]-3-propan-2-yloxypropan-1-amine
CID 80701789
N-[2-(7-methoxy-1-benzofuran-2-yl)ethyl]propan-1-amine
CID 70555736

Frequently Asked Questions

What is the IUPAC name of N-[2-(8-methoxyquinolin-2-yl)ethyl]propan-1-amine?
The IUPAC name of N-[2-(8-methoxyquinolin-2-yl)ethyl]propan-1-amine (CID 80703316) is N-[2-(8-methoxyquinolin-2-yl)ethyl]propan-1-amine.
What is the SMILES notation for N-[2-(8-methoxyquinolin-2-yl)ethyl]propan-1-amine?
The canonical SMILES for N-[2-(8-methoxyquinolin-2-yl)ethyl]propan-1-amine is CCCNCCc1ccc2cccc(OC)c2n1.
What is the InChIKey of N-[2-(8-methoxyquinolin-2-yl)ethyl]propan-1-amine?
The InChIKey is OMYKQLFKKIHABF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-3-10-16-11-9-13-8-7-12-5-4-6-14(18-2)15(12)17-13/h4-8,16H,3,9-11H2,1-2H3.
What are the key properties of N-[2-(8-methoxyquinolin-2-yl)ethyl]propan-1-amine?
N-[2-(8-methoxyquinolin-2-yl)ethyl]propan-1-amine has a molecular weight of 244.34 g/mol, XLogP of 2.79, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(8-methoxyquinolin-2-yl)ethyl]propan-1-amine is sourced from PubChem (CID 80703316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).