2-[(6-ethoxy-4-oxo-1H-quinoline-3-carbonyl)amino]ethyl-diethylazanium

C18H26N3O3+ — CID 7391284

IUPAC2-[(6-ethoxy-4-oxo-1H-quinoline-3-carbonyl)amino]ethyl-diethylazanium
SMILESCCOc1ccc2[nH]cc(C(=O)NCC[NH+](CC)CC)c(=O)c2c1
InChIInChI=1S/C18H25N3O3/c1-4-21(5-2)10-9-19-18(23)15-12-20-16-8-7-13(24-6-3)11-14(16)17(15)22/h7-8,11-12H,4-6,9-10H2,1-3H3,(H,19,23)(H,20,22)/p+1
InChIKeyPCBINKBSWVOKMV-UHFFFAOYSA-O
MW332.42 g/mol
LogP0.58
Rot. Bonds8

About 2-[(6-ethoxy-4-oxo-1H-quinoline-3-carbonyl)amino]ethyl-diethylazanium

2-[(6-ethoxy-4-oxo-1H-quinoline-3-carbonyl)amino]ethyl-diethylazanium (PubChem CID 7391284) has the molecular formula C18H26N3O3+ and a molecular weight of 332.42 g/mol. Its IUPAC name is 2-[(6-ethoxy-4-oxo-1H-quinoline-3-carbonyl)amino]ethyl-diethylazanium.

Molecular Properties

Compound Name2-[(6-ethoxy-4-oxo-1H-quinoline-3-carbonyl)amino]ethyl-diethylazanium
PubChem CID7391284
Molecular FormulaC18H26N3O3+
Molecular Weight332.42 g/mol
Exact Mass332.20
IUPAC Name2-[(6-ethoxy-4-oxo-1H-quinoline-3-carbonyl)amino]ethyl-diethylazanium
SMILESCCOc1ccc2[nH]cc(C(=O)NCC[NH+](CC)CC)c(=O)c2c1
InChIInChI=1S/C18H25N3O3/c1-4-21(5-2)10-9-19-18(23)15-12-20-16-8-7-13(24-6-3)11-14(16)17(15)22/h7-8,11-12H,4-6,9-10H2,1-3H3,(H,19,23)(H,20,22)/p+1
InChIKeyPCBINKBSWVOKMV-UHFFFAOYSA-O
XLogP0.58
TPSA75.63 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.42
LogP ≤ 50.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-[(6-ethoxy-4-oxo-1H-quinoline-3-carbonyl)amino]ethyl-diethylazanium with MolForge

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Related Compounds

diethyl-[2-[(6-methoxy-4-oxo-1H-quinoline-3-carbonyl)amino]ethyl]azanium
CID 7391278
6-ethoxy-N-(3-methylbutyl)-4-oxo-1H-quinoline-3-carboxamide
CID 18473151
N-(2-hydroxyethyl)-6-methoxy-4-oxo-1H-quinoline-3-carboxamide
CID 43813799
3-benzoyl-6-ethoxy-1H-quinolin-4-one
CID 4605296
6-methoxy-4-oxo-1H-quinoline-3-carbohydrazide
CID 95233454
6-[(4-ethoxyphenyl)sulfamoyl]-N-(3-methoxypropyl)-4-oxo-1H-quinoline-3-carboxamide
CID 20854286
6-[(4-ethoxyphenyl)sulfamoyl]-4-oxo-N-(2-phenylethyl)-1H-quinoline-3-carboxamide
CID 3522985
6-ethoxy-N-[[3-(imidazol-1-ylmethyl)phenyl]methyl]-4-oxo-1H-quinoline-3-carboxamide
CID 18473047
6-ethoxy-3-(3-methoxybenzoyl)-1H-quinolin-4-one
CID 4609629
N-benzyl-6-methoxy-4-oxo-1H-quinoline-3-carboxamide
CID 18473067
1-(5-ethoxy-1H-indol-3-yl)heptan-1-one
CID 114752203
N-butyl-6-(methoxymethyl)-4-oxo-1H-quinoline-3-carboxamide
CID 18473157

Frequently Asked Questions

What is the IUPAC name of 2-[(6-ethoxy-4-oxo-1H-quinoline-3-carbonyl)amino]ethyl-diethylazanium?
The IUPAC name of 2-[(6-ethoxy-4-oxo-1H-quinoline-3-carbonyl)amino]ethyl-diethylazanium (CID 7391284) is 2-[(6-ethoxy-4-oxo-1H-quinoline-3-carbonyl)amino]ethyl-diethylazanium.
What is the SMILES notation for 2-[(6-ethoxy-4-oxo-1H-quinoline-3-carbonyl)amino]ethyl-diethylazanium?
The canonical SMILES for 2-[(6-ethoxy-4-oxo-1H-quinoline-3-carbonyl)amino]ethyl-diethylazanium is CCOc1ccc2[nH]cc(C(=O)NCC[NH+](CC)CC)c(=O)c2c1.
What is the InChIKey of 2-[(6-ethoxy-4-oxo-1H-quinoline-3-carbonyl)amino]ethyl-diethylazanium?
The InChIKey is PCBINKBSWVOKMV-UHFFFAOYSA-O. The full InChI is InChI=1S/C18H25N3O3/c1-4-21(5-2)10-9-19-18(23)15-12-20-16-8-7-13(24-6-3)11-14(16)17(15)22/h7-8,11-12H,4-6,9-10H2,1-3H3,(H,19,23)(H,20,22)/p+1.
What are the key properties of 2-[(6-ethoxy-4-oxo-1H-quinoline-3-carbonyl)amino]ethyl-diethylazanium?
2-[(6-ethoxy-4-oxo-1H-quinoline-3-carbonyl)amino]ethyl-diethylazanium has a molecular weight of 332.42 g/mol, XLogP of 0.58, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-ethoxy-4-oxo-1H-quinoline-3-carbonyl)amino]ethyl-diethylazanium is sourced from PubChem (CID 7391284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).