3-ethoxy-N-(2-quinolin-8-yloxyethyl)propan-1-amine

C16H22N2O2 — CID 62598028

IUPAC3-ethoxy-N-(2-quinolin-8-yloxyethyl)propan-1-amine
SMILESCCOCCCNCCOc1cccc2cccnc12
InChIInChI=1S/C16H22N2O2/c1-2-19-12-5-9-17-11-13-20-15-8-3-6-14-7-4-10-18-16(14)15/h3-4,6-8,10,17H,2,5,9,11-13H2,1H3
InChIKeyHETXGBMFBVOURX-UHFFFAOYSA-N
MW274.36 g/mol
LogP2.63
Rot. Bonds9

About 3-ethoxy-N-(2-quinolin-8-yloxyethyl)propan-1-amine

3-ethoxy-N-(2-quinolin-8-yloxyethyl)propan-1-amine (PubChem CID 62598028) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is 3-ethoxy-N-(2-quinolin-8-yloxyethyl)propan-1-amine.

Molecular Properties

Compound Name3-ethoxy-N-(2-quinolin-8-yloxyethyl)propan-1-amine
PubChem CID62598028
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC Name3-ethoxy-N-(2-quinolin-8-yloxyethyl)propan-1-amine
SMILESCCOCCCNCCOc1cccc2cccnc12
InChIInChI=1S/C16H22N2O2/c1-2-19-12-5-9-17-11-13-20-15-8-3-6-14-7-4-10-18-16(14)15/h3-4,6-8,10,17H,2,5,9,11-13H2,1H3
InChIKeyHETXGBMFBVOURX-UHFFFAOYSA-N
XLogP2.63
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-propyl-5-quinolin-8-yloxypentan-1-amine
CID 62484408
N-(3-ethoxypropyl)-2-quinolin-8-yloxyacetamide
CID 71408811
2-quinolin-8-yloxyethylhydrazine
CID 82126133
N-(2-quinolin-8-yloxyethyl)propan-2-amine
CID 29015226
3-ethoxy-N-[2-(2-methylphenoxy)ethyl]propan-1-amine
CID 55024091
N-[2-(2-tert-butylphenoxy)ethyl]-3-ethoxypropan-1-amine
CID 62571642
1-butyl-3-(2-quinolin-8-yloxyethyl)urea
CID 112975943
3-ethoxy-N-[2-(2-fluorophenoxy)ethyl]propan-1-amine
CID 60689845
N-(2-quinolin-8-yloxyethyl)cyclopentanamine
CID 62599062
2-ethoxyethyl 2-quinolin-8-yloxyacetate
CID 71408852
1-cyclopropyl-N-(2-quinolin-8-yloxyethyl)ethanamine
CID 62598191
8-(6-chlorohexoxy)quinoline
CID 62228191

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-(2-quinolin-8-yloxyethyl)propan-1-amine?
The IUPAC name of 3-ethoxy-N-(2-quinolin-8-yloxyethyl)propan-1-amine (CID 62598028) is 3-ethoxy-N-(2-quinolin-8-yloxyethyl)propan-1-amine.
What is the SMILES notation for 3-ethoxy-N-(2-quinolin-8-yloxyethyl)propan-1-amine?
The canonical SMILES for 3-ethoxy-N-(2-quinolin-8-yloxyethyl)propan-1-amine is CCOCCCNCCOc1cccc2cccnc12.
What is the InChIKey of 3-ethoxy-N-(2-quinolin-8-yloxyethyl)propan-1-amine?
The InChIKey is HETXGBMFBVOURX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-2-19-12-5-9-17-11-13-20-15-8-3-6-14-7-4-10-18-16(14)15/h3-4,6-8,10,17H,2,5,9,11-13H2,1H3.
What are the key properties of 3-ethoxy-N-(2-quinolin-8-yloxyethyl)propan-1-amine?
3-ethoxy-N-(2-quinolin-8-yloxyethyl)propan-1-amine has a molecular weight of 274.36 g/mol, XLogP of 2.63, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-(2-quinolin-8-yloxyethyl)propan-1-amine is sourced from PubChem (CID 62598028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).