6-ethoxy-3-ethyl-2-methyl-N-propylquinolin-4-amine

C17H24N2O — CID 63480039

IUPAC6-ethoxy-3-ethyl-2-methyl-N-propylquinolin-4-amine
SMILESCCCNc1c(CC)c(C)nc2ccc(OCC)cc12
InChIInChI=1S/C17H24N2O/c1-5-10-18-17-14(6-2)12(4)19-16-9-8-13(20-7-3)11-15(16)17/h8-9,11H,5-7,10H2,1-4H3,(H,18,19)
InChIKeyVHXAHXULLTYXSO-UHFFFAOYSA-N
MW272.39 g/mol
LogP4.33
Rot. Bonds6

About 6-ethoxy-3-ethyl-2-methyl-N-propylquinolin-4-amine

6-ethoxy-3-ethyl-2-methyl-N-propylquinolin-4-amine (PubChem CID 63480039) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is 6-ethoxy-3-ethyl-2-methyl-N-propylquinolin-4-amine.

Molecular Properties

Compound Name6-ethoxy-3-ethyl-2-methyl-N-propylquinolin-4-amine
PubChem CID63480039
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC Name6-ethoxy-3-ethyl-2-methyl-N-propylquinolin-4-amine
SMILESCCCNc1c(CC)c(C)nc2ccc(OCC)cc12
InChIInChI=1S/C17H24N2O/c1-5-10-18-17-14(6-2)12(4)19-16-9-8-13(20-7-3)11-15(16)17/h8-9,11H,5-7,10H2,1-4H3,(H,18,19)
InChIKeyVHXAHXULLTYXSO-UHFFFAOYSA-N
XLogP4.33
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-3-ethyl-2-methyl-N-propylquinolin-4-amine?
The IUPAC name of 6-ethoxy-3-ethyl-2-methyl-N-propylquinolin-4-amine (CID 63480039) is 6-ethoxy-3-ethyl-2-methyl-N-propylquinolin-4-amine.
What is the SMILES notation for 6-ethoxy-3-ethyl-2-methyl-N-propylquinolin-4-amine?
The canonical SMILES for 6-ethoxy-3-ethyl-2-methyl-N-propylquinolin-4-amine is CCCNc1c(CC)c(C)nc2ccc(OCC)cc12.
What is the InChIKey of 6-ethoxy-3-ethyl-2-methyl-N-propylquinolin-4-amine?
The InChIKey is VHXAHXULLTYXSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c1-5-10-18-17-14(6-2)12(4)19-16-9-8-13(20-7-3)11-15(16)17/h8-9,11H,5-7,10H2,1-4H3,(H,18,19).
What are the key properties of 6-ethoxy-3-ethyl-2-methyl-N-propylquinolin-4-amine?
6-ethoxy-3-ethyl-2-methyl-N-propylquinolin-4-amine has a molecular weight of 272.39 g/mol, XLogP of 4.33, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-3-ethyl-2-methyl-N-propylquinolin-4-amine is sourced from PubChem (CID 63480039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).