2-(8-aminoquinolin-5-yl)oxy-N-ethyl-N-methylacetamide

C14H17N3O2 — CID 116524643

IUPAC2-(8-aminoquinolin-5-yl)oxy-N-ethyl-N-methylacetamide
SMILESCCN(C)C(=O)COc1ccc(N)c2ncccc12
InChIInChI=1S/C14H17N3O2/c1-3-17(2)13(18)9-19-12-7-6-11(15)14-10(12)5-4-8-16-14/h4-8H,3,9,15H2,1-2H3
InChIKeyHNVVZQSZWYYYQL-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.67
Rot. Bonds4

About 2-(8-aminoquinolin-5-yl)oxy-N-ethyl-N-methylacetamide

2-(8-aminoquinolin-5-yl)oxy-N-ethyl-N-methylacetamide (PubChem CID 116524643) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 2-(8-aminoquinolin-5-yl)oxy-N-ethyl-N-methylacetamide.

Molecular Properties

Compound Name2-(8-aminoquinolin-5-yl)oxy-N-ethyl-N-methylacetamide
PubChem CID116524643
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name2-(8-aminoquinolin-5-yl)oxy-N-ethyl-N-methylacetamide
SMILESCCN(C)C(=O)COc1ccc(N)c2ncccc12
InChIInChI=1S/C14H17N3O2/c1-3-17(2)13(18)9-19-12-7-6-11(15)14-10(12)5-4-8-16-14/h4-8H,3,9,15H2,1-2H3
InChIKeyHNVVZQSZWYYYQL-UHFFFAOYSA-N
XLogP1.67
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(8-aminoquinolin-5-yl)oxyacetamide
CID 116524742
5-(methoxymethoxy)quinolin-8-amine
CID 116524711
2-(8-aminoquinolin-5-yl)oxy-N-butan-2-ylacetamide
CID 116524797
2-(5-aminoquinolin-8-yl)oxy-N-cyclopropyl-N-methylacetamide
CID 61488649
2-(8-aminoquinolin-5-yl)oxy-N-propylpropanamide
CID 116524725
2-[(2-amino-6-methyl-3-pyridinyl)oxy]-N-ethyl-N-methylacetamide
CID 62097636
5-(pyrimidin-2-ylmethoxy)quinolin-8-amine
CID 116524814
2-(2-amino-5-methoxyphenoxy)-N-ethyl-N-methylacetamide
CID 102702283
5-(3,3-dimethylbutoxy)quinolin-8-amine
CID 66233789
N-ethyl-2-[1-(hydroxymethyl)naphthalen-2-yl]oxy-N-methylacetamide
CID 43505701
2-[2-[ethyl(methyl)amino]-2-oxoethoxy]naphthalene-1-carboxylic acid
CID 43505649
2-(4-amino-2-chlorophenoxy)-N-ethyl-N-methylacetamide
CID 43309382

Frequently Asked Questions

What is the IUPAC name of 2-(8-aminoquinolin-5-yl)oxy-N-ethyl-N-methylacetamide?
The IUPAC name of 2-(8-aminoquinolin-5-yl)oxy-N-ethyl-N-methylacetamide (CID 116524643) is 2-(8-aminoquinolin-5-yl)oxy-N-ethyl-N-methylacetamide.
What is the SMILES notation for 2-(8-aminoquinolin-5-yl)oxy-N-ethyl-N-methylacetamide?
The canonical SMILES for 2-(8-aminoquinolin-5-yl)oxy-N-ethyl-N-methylacetamide is CCN(C)C(=O)COc1ccc(N)c2ncccc12.
What is the InChIKey of 2-(8-aminoquinolin-5-yl)oxy-N-ethyl-N-methylacetamide?
The InChIKey is HNVVZQSZWYYYQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-3-17(2)13(18)9-19-12-7-6-11(15)14-10(12)5-4-8-16-14/h4-8H,3,9,15H2,1-2H3.
What are the key properties of 2-(8-aminoquinolin-5-yl)oxy-N-ethyl-N-methylacetamide?
2-(8-aminoquinolin-5-yl)oxy-N-ethyl-N-methylacetamide has a molecular weight of 259.31 g/mol, XLogP of 1.67, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-aminoquinolin-5-yl)oxy-N-ethyl-N-methylacetamide is sourced from PubChem (CID 116524643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).