2-ethyl-6-fluoro-8-methoxyquinolin-4-amine

C12H13FN2O — CID 62198047

IUPAC2-ethyl-6-fluoro-8-methoxyquinolin-4-amine
SMILESCCc1cc(N)c2cc(F)cc(OC)c2n1
InChIInChI=1S/C12H13FN2O/c1-3-8-6-10(14)9-4-7(13)5-11(16-2)12(9)15-8/h4-6H,3H2,1-2H3,(H2,14,15)
InChIKeyNZURXWWDGDFHLN-UHFFFAOYSA-N
MW220.25 g/mol
LogP2.53
Rot. Bonds2

About 2-ethyl-6-fluoro-8-methoxyquinolin-4-amine

2-ethyl-6-fluoro-8-methoxyquinolin-4-amine (PubChem CID 62198047) has the molecular formula C12H13FN2O and a molecular weight of 220.25 g/mol. Its IUPAC name is 2-ethyl-6-fluoro-8-methoxyquinolin-4-amine.

Molecular Properties

Compound Name2-ethyl-6-fluoro-8-methoxyquinolin-4-amine
PubChem CID62198047
Molecular FormulaC12H13FN2O
Molecular Weight220.25 g/mol
Exact Mass220.10
IUPAC Name2-ethyl-6-fluoro-8-methoxyquinolin-4-amine
SMILESCCc1cc(N)c2cc(F)cc(OC)c2n1
InChIInChI=1S/C12H13FN2O/c1-3-8-6-10(14)9-4-7(13)5-11(16-2)12(9)15-8/h4-6H,3H2,1-2H3,(H2,14,15)
InChIKeyNZURXWWDGDFHLN-UHFFFAOYSA-N
XLogP2.53
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.25
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6-fluoro-8-methoxyquinolin-4-amine?
The IUPAC name of 2-ethyl-6-fluoro-8-methoxyquinolin-4-amine (CID 62198047) is 2-ethyl-6-fluoro-8-methoxyquinolin-4-amine.
What is the SMILES notation for 2-ethyl-6-fluoro-8-methoxyquinolin-4-amine?
The canonical SMILES for 2-ethyl-6-fluoro-8-methoxyquinolin-4-amine is CCc1cc(N)c2cc(F)cc(OC)c2n1.
What is the InChIKey of 2-ethyl-6-fluoro-8-methoxyquinolin-4-amine?
The InChIKey is NZURXWWDGDFHLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13FN2O/c1-3-8-6-10(14)9-4-7(13)5-11(16-2)12(9)15-8/h4-6H,3H2,1-2H3,(H2,14,15).
What are the key properties of 2-ethyl-6-fluoro-8-methoxyquinolin-4-amine?
2-ethyl-6-fluoro-8-methoxyquinolin-4-amine has a molecular weight of 220.25 g/mol, XLogP of 2.53, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-fluoro-8-methoxyquinolin-4-amine is sourced from PubChem (CID 62198047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).