2-(5-aminoquinolin-8-yl)oxy-N,N-dimethylpropanamide

C14H17N3O2 — CID 60865141

IUPAC2-(5-aminoquinolin-8-yl)oxy-N,N-dimethylpropanamide
SMILESCC(Oc1ccc(N)c2cccnc12)C(=O)N(C)C
InChIInChI=1S/C14H17N3O2/c1-9(14(18)17(2)3)19-12-7-6-11(15)10-5-4-8-16-13(10)12/h4-9H,15H2,1-3H3
InChIKeyXLRGYNGEAMYGPN-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.67
Rot. Bonds3

About 2-(5-aminoquinolin-8-yl)oxy-N,N-dimethylpropanamide

2-(5-aminoquinolin-8-yl)oxy-N,N-dimethylpropanamide (PubChem CID 60865141) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 2-(5-aminoquinolin-8-yl)oxy-N,N-dimethylpropanamide.

Molecular Properties

Compound Name2-(5-aminoquinolin-8-yl)oxy-N,N-dimethylpropanamide
PubChem CID60865141
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name2-(5-aminoquinolin-8-yl)oxy-N,N-dimethylpropanamide
SMILESCC(Oc1ccc(N)c2cccnc12)C(=O)N(C)C
InChIInChI=1S/C14H17N3O2/c1-9(14(18)17(2)3)19-12-7-6-11(15)10-5-4-8-16-13(10)12/h4-9H,15H2,1-3H3
InChIKeyXLRGYNGEAMYGPN-UHFFFAOYSA-N
XLogP1.67
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
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-(5-aminoquinolin-8-yl)oxy-N,N-diethylpropanamide
CID 60863149
3-(5-aminoquinolin-8-yl)oxy-2-methylpropanamide
CID 60863326
2-(8-aminoquinolin-5-yl)oxy-N-carbamoylpropanamide
CID 116524840
2-(5-aminoquinolin-8-yl)oxy-N-(3-methylbutan-2-yl)acetamide
CID 61489515
4-amino-3-[1-(dimethylamino)-1-oxopropan-2-yl]oxybenzoic acid
CID 43379835
2-(5-aminoquinolin-8-yl)oxy-N-cyclopropyl-N-methylacetamide
CID 61488649
2-(8-aminoquinolin-5-yl)oxy-N-propylpropanamide
CID 116524725
8-(2-methoxypropoxy)quinolin-5-amine
CID 113382666
5-propan-2-yloxyquinolin-8-amine
CID 43449641
2-(2-amino-5-chlorophenoxy)-N,N-dimethylpropanamide
CID 62303980
3-[1-(dimethylamino)-1-oxopropan-2-yl]oxyquinoline-4-carboxylic acid
CID 79591700
8-cyclopropyloxyquinolin-5-amine
CID 156698468

Frequently Asked Questions

What is the IUPAC name of 2-(5-aminoquinolin-8-yl)oxy-N,N-dimethylpropanamide?
The IUPAC name of 2-(5-aminoquinolin-8-yl)oxy-N,N-dimethylpropanamide (CID 60865141) is 2-(5-aminoquinolin-8-yl)oxy-N,N-dimethylpropanamide.
What is the SMILES notation for 2-(5-aminoquinolin-8-yl)oxy-N,N-dimethylpropanamide?
The canonical SMILES for 2-(5-aminoquinolin-8-yl)oxy-N,N-dimethylpropanamide is CC(Oc1ccc(N)c2cccnc12)C(=O)N(C)C.
What is the InChIKey of 2-(5-aminoquinolin-8-yl)oxy-N,N-dimethylpropanamide?
The InChIKey is XLRGYNGEAMYGPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-9(14(18)17(2)3)19-12-7-6-11(15)10-5-4-8-16-13(10)12/h4-9H,15H2,1-3H3.
What are the key properties of 2-(5-aminoquinolin-8-yl)oxy-N,N-dimethylpropanamide?
2-(5-aminoquinolin-8-yl)oxy-N,N-dimethylpropanamide has a molecular weight of 259.31 g/mol, XLogP of 1.67, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-aminoquinolin-8-yl)oxy-N,N-dimethylpropanamide is sourced from PubChem (CID 60865141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).