2-amino-N-[2-(2-methoxyethoxy)ethyl]quinoline-4-carboxamide

C15H19N3O3 — CID 62160032

IUPAC2-amino-N-[2-(2-methoxyethoxy)ethyl]quinoline-4-carboxamide
SMILESCOCCOCCNC(=O)c1cc(N)nc2ccccc12
InChIInChI=1S/C15H19N3O3/c1-20-8-9-21-7-6-17-15(19)12-10-14(16)18-13-5-3-2-4-11(12)13/h2-5,10H,6-9H2,1H3,(H2,16,18)(H,17,19)
InChIKeyQTXYJEHHIKPWHW-UHFFFAOYSA-N
MW289.34 g/mol
LogP1.21
Rot. Bonds7

About 2-amino-N-[2-(2-methoxyethoxy)ethyl]quinoline-4-carboxamide

2-amino-N-[2-(2-methoxyethoxy)ethyl]quinoline-4-carboxamide (PubChem CID 62160032) has the molecular formula C15H19N3O3 and a molecular weight of 289.34 g/mol. Its IUPAC name is 2-amino-N-[2-(2-methoxyethoxy)ethyl]quinoline-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-[2-(2-methoxyethoxy)ethyl]quinoline-4-carboxamide
PubChem CID62160032
Molecular FormulaC15H19N3O3
Molecular Weight289.34 g/mol
Exact Mass289.14
IUPAC Name2-amino-N-[2-(2-methoxyethoxy)ethyl]quinoline-4-carboxamide
SMILESCOCCOCCNC(=O)c1cc(N)nc2ccccc12
InChIInChI=1S/C15H19N3O3/c1-20-8-9-21-7-6-17-15(19)12-10-14(16)18-13-5-3-2-4-11(12)13/h2-5,10H,6-9H2,1H3,(H2,16,18)(H,17,19)
InChIKeyQTXYJEHHIKPWHW-UHFFFAOYSA-N
XLogP1.21
TPSA86.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-(2-methylsulfonylethyl)quinoline-4-carboxamide
CID 62152474
2-hydrazinyl-N-(2-methoxyethyl)quinoline-4-carboxamide
CID 62235922
2-amino-N-[2-[methyl(propan-2-yl)amino]ethyl]quinoline-4-carboxamide
CID 62640770
2-amino-N-(2-sulfamoylethyl)quinoline-4-carboxamide
CID 62155502
2-amino-N-(4-methylpentyl)quinoline-4-carboxamide
CID 63002970
2-amino-N-(4,4,4-trifluorobutyl)quinoline-4-carboxamide
CID 115522077
2-amino-N-(1-methoxy-3-methylbutan-2-yl)quinoline-4-carboxamide
CID 65053035
N-(2-methoxyethyl)-2-(propylamino)quinoline-4-carboxamide
CID 62170948
1-amino-N-[2-(2-methoxyethoxy)ethyl]isoquinoline-3-carboxamide
CID 62160545
2-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)quinoline-4-carboxamide
CID 106280040
2-(4-chlorophenyl)-N-[3-(2-methoxyethoxy)propyl]quinoline-4-carboxamide
CID 55407847
4-amino-N-(2-butoxyethyl)quinoline-2-carboxamide
CID 63375414

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(2-methoxyethoxy)ethyl]quinoline-4-carboxamide?
The IUPAC name of 2-amino-N-[2-(2-methoxyethoxy)ethyl]quinoline-4-carboxamide (CID 62160032) is 2-amino-N-[2-(2-methoxyethoxy)ethyl]quinoline-4-carboxamide.
What is the SMILES notation for 2-amino-N-[2-(2-methoxyethoxy)ethyl]quinoline-4-carboxamide?
The canonical SMILES for 2-amino-N-[2-(2-methoxyethoxy)ethyl]quinoline-4-carboxamide is COCCOCCNC(=O)c1cc(N)nc2ccccc12.
What is the InChIKey of 2-amino-N-[2-(2-methoxyethoxy)ethyl]quinoline-4-carboxamide?
The InChIKey is QTXYJEHHIKPWHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c1-20-8-9-21-7-6-17-15(19)12-10-14(16)18-13-5-3-2-4-11(12)13/h2-5,10H,6-9H2,1H3,(H2,16,18)(H,17,19).
What are the key properties of 2-amino-N-[2-(2-methoxyethoxy)ethyl]quinoline-4-carboxamide?
2-amino-N-[2-(2-methoxyethoxy)ethyl]quinoline-4-carboxamide has a molecular weight of 289.34 g/mol, XLogP of 1.21, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(2-methoxyethoxy)ethyl]quinoline-4-carboxamide is sourced from PubChem (CID 62160032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).