5,8-diethoxy-3-ethyl-N-methylquinolin-2-amine

C16H22N2O2 — CID 63531557

IUPAC5,8-diethoxy-3-ethyl-N-methylquinolin-2-amine
SMILESCCOc1ccc(OCC)c2nc(NC)c(CC)cc12
InChIInChI=1S/C16H22N2O2/c1-5-11-10-12-13(19-6-2)8-9-14(20-7-3)15(12)18-16(11)17-4/h8-10H,5-7H2,1-4H3,(H,17,18)
InChIKeyNIQGXKQWNPYWBT-UHFFFAOYSA-N
MW274.36 g/mol
LogP3.64
Rot. Bonds6

About 5,8-diethoxy-3-ethyl-N-methylquinolin-2-amine

5,8-diethoxy-3-ethyl-N-methylquinolin-2-amine (PubChem CID 63531557) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is 5,8-diethoxy-3-ethyl-N-methylquinolin-2-amine.

Molecular Properties

Compound Name5,8-diethoxy-3-ethyl-N-methylquinolin-2-amine
PubChem CID63531557
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC Name5,8-diethoxy-3-ethyl-N-methylquinolin-2-amine
SMILESCCOc1ccc(OCC)c2nc(NC)c(CC)cc12
InChIInChI=1S/C16H22N2O2/c1-5-11-10-12-13(19-6-2)8-9-14(20-7-3)15(12)18-16(11)17-4/h8-10H,5-7H2,1-4H3,(H,17,18)
InChIKeyNIQGXKQWNPYWBT-UHFFFAOYSA-N
XLogP3.64
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-3-ethyl-8-methoxy-N-methylquinolin-2-amine
CID 63232251
3-ethyl-5,8-dimethoxy-N-propylquinolin-2-amine
CID 63524526
5,8-diethoxy-3-methylquinolin-2-amine
CID 63232028
3-ethyl-5,8-difluoro-N,6-dimethylquinolin-2-amine
CID 103587513
(5-bromo-3-ethyl-8-methoxyquinolin-2-yl)hydrazine
CID 63233442
5-(4-ethoxy-3-ethylphenyl)-N-methylpyridin-2-amine
CID 143670067
3-ethyl-5,6,7-trifluoro-N-methylquinolin-2-amine
CID 63232484
3-ethyl-N,5,7-trimethylquinolin-2-amine
CID 63231542
5,8-diethoxy-2-ethyl-N,3-dimethylquinolin-4-amine
CID 63562056
5,7-dichloro-3-ethyl-N-methylquinolin-2-amine
CID 63531730
(2S)-7,10-diethoxy-2-methyl-2,3,4,5-tetrahydro-[1,4]oxazepino[7,6-b]quinoline
CID 92593581
5,8-diethoxy-N-methyl-2-propylquinolin-4-amine
CID 63480709

Frequently Asked Questions

What is the IUPAC name of 5,8-diethoxy-3-ethyl-N-methylquinolin-2-amine?
The IUPAC name of 5,8-diethoxy-3-ethyl-N-methylquinolin-2-amine (CID 63531557) is 5,8-diethoxy-3-ethyl-N-methylquinolin-2-amine.
What is the SMILES notation for 5,8-diethoxy-3-ethyl-N-methylquinolin-2-amine?
The canonical SMILES for 5,8-diethoxy-3-ethyl-N-methylquinolin-2-amine is CCOc1ccc(OCC)c2nc(NC)c(CC)cc12.
What is the InChIKey of 5,8-diethoxy-3-ethyl-N-methylquinolin-2-amine?
The InChIKey is NIQGXKQWNPYWBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-5-11-10-12-13(19-6-2)8-9-14(20-7-3)15(12)18-16(11)17-4/h8-10H,5-7H2,1-4H3,(H,17,18).
What are the key properties of 5,8-diethoxy-3-ethyl-N-methylquinolin-2-amine?
5,8-diethoxy-3-ethyl-N-methylquinolin-2-amine has a molecular weight of 274.36 g/mol, XLogP of 3.64, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,8-diethoxy-3-ethyl-N-methylquinolin-2-amine is sourced from PubChem (CID 63531557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).