8-fluoro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine

C15H19FN2O — CID 55062348

IUPAC8-fluoro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine
SMILESCCCNc1cc(COC)nc2c(F)cc(C)cc12
InChIInChI=1S/C15H19FN2O/c1-4-5-17-14-8-11(9-19-3)18-15-12(14)6-10(2)7-13(15)16/h6-8H,4-5,9H2,1-3H3,(H,17,18)
InChIKeyICZSITBXCIUJHH-UHFFFAOYSA-N
MW262.33 g/mol
LogP3.65
Rot. Bonds5

About 8-fluoro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine

8-fluoro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine (PubChem CID 55062348) has the molecular formula C15H19FN2O and a molecular weight of 262.33 g/mol. Its IUPAC name is 8-fluoro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine.

Molecular Properties

Compound Name8-fluoro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine
PubChem CID55062348
Molecular FormulaC15H19FN2O
Molecular Weight262.33 g/mol
Exact Mass262.15
IUPAC Name8-fluoro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine
SMILESCCCNc1cc(COC)nc2c(F)cc(C)cc12
InChIInChI=1S/C15H19FN2O/c1-4-5-17-14-8-11(9-19-3)18-15-12(14)6-10(2)7-13(15)16/h6-8H,4-5,9H2,1-3H3,(H,17,18)
InChIKeyICZSITBXCIUJHH-UHFFFAOYSA-N
XLogP3.65
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-fluoro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine?
The IUPAC name of 8-fluoro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine (CID 55062348) is 8-fluoro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine.
What is the SMILES notation for 8-fluoro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine?
The canonical SMILES for 8-fluoro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine is CCCNc1cc(COC)nc2c(F)cc(C)cc12.
What is the InChIKey of 8-fluoro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine?
The InChIKey is ICZSITBXCIUJHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O/c1-4-5-17-14-8-11(9-19-3)18-15-12(14)6-10(2)7-13(15)16/h6-8H,4-5,9H2,1-3H3,(H,17,18).
What are the key properties of 8-fluoro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine?
8-fluoro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine has a molecular weight of 262.33 g/mol, XLogP of 3.65, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine is sourced from PubChem (CID 55062348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).