(8-fluoro-5-methoxyquinolin-2-yl)methanamine

C11H11FN2O — CID 102941402

IUPAC(8-fluoro-5-methoxyquinolin-2-yl)methanamine
SMILESCOc1ccc(F)c2nc(CN)ccc12
InChIInChI=1S/C11H11FN2O/c1-15-10-5-4-9(12)11-8(10)3-2-7(6-13)14-11/h2-5H,6,13H2,1H3
InChIKeyODVJSRLPQJNJDM-UHFFFAOYSA-N
MW206.22 g/mol
LogP1.84
Rot. Bonds2

About (8-fluoro-5-methoxyquinolin-2-yl)methanamine

(8-fluoro-5-methoxyquinolin-2-yl)methanamine (PubChem CID 102941402) has the molecular formula C11H11FN2O and a molecular weight of 206.22 g/mol. Its IUPAC name is (8-fluoro-5-methoxyquinolin-2-yl)methanamine.

Molecular Properties

Compound Name(8-fluoro-5-methoxyquinolin-2-yl)methanamine
PubChem CID102941402
Molecular FormulaC11H11FN2O
Molecular Weight206.22 g/mol
Exact Mass206.09
IUPAC Name(8-fluoro-5-methoxyquinolin-2-yl)methanamine
SMILESCOc1ccc(F)c2nc(CN)ccc12
InChIInChI=1S/C11H11FN2O/c1-15-10-5-4-9(12)11-8(10)3-2-7(6-13)14-11/h2-5H,6,13H2,1H3
InChIKeyODVJSRLPQJNJDM-UHFFFAOYSA-N
XLogP1.84
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.22
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (8-fluoro-5-methoxyquinolin-2-yl)methanamine?
The IUPAC name of (8-fluoro-5-methoxyquinolin-2-yl)methanamine (CID 102941402) is (8-fluoro-5-methoxyquinolin-2-yl)methanamine.
What is the SMILES notation for (8-fluoro-5-methoxyquinolin-2-yl)methanamine?
The canonical SMILES for (8-fluoro-5-methoxyquinolin-2-yl)methanamine is COc1ccc(F)c2nc(CN)ccc12.
What is the InChIKey of (8-fluoro-5-methoxyquinolin-2-yl)methanamine?
The InChIKey is ODVJSRLPQJNJDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2O/c1-15-10-5-4-9(12)11-8(10)3-2-7(6-13)14-11/h2-5H,6,13H2,1H3.
What are the key properties of (8-fluoro-5-methoxyquinolin-2-yl)methanamine?
(8-fluoro-5-methoxyquinolin-2-yl)methanamine has a molecular weight of 206.22 g/mol, XLogP of 1.84, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (8-fluoro-5-methoxyquinolin-2-yl)methanamine is sourced from PubChem (CID 102941402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).