2-(7-fluoro-2H-1,5-naphthyridin-1-yl)-1-methoxyethanol

C11H13FN2O2 — CID 141190550

IUPAC2-(7-fluoro-2H-1,5-naphthyridin-1-yl)-1-methoxyethanol
SMILESCOC(O)CN1CC=Cc2ncc(F)cc21
InChIInChI=1S/C11H13FN2O2/c1-16-11(15)7-14-4-2-3-9-10(14)5-8(12)6-13-9/h2-3,5-6,11,15H,4,7H2,1H3
InChIKeyZRHJNSNKSIKGAA-UHFFFAOYSA-N
MW224.24 g/mol
LogP1.02
Rot. Bonds3

About 2-(7-fluoro-2H-1,5-naphthyridin-1-yl)-1-methoxyethanol

2-(7-fluoro-2H-1,5-naphthyridin-1-yl)-1-methoxyethanol (PubChem CID 141190550) has the molecular formula C11H13FN2O2 and a molecular weight of 224.24 g/mol. Its IUPAC name is 2-(7-fluoro-2H-1,5-naphthyridin-1-yl)-1-methoxyethanol.

Molecular Properties

Compound Name2-(7-fluoro-2H-1,5-naphthyridin-1-yl)-1-methoxyethanol
PubChem CID141190550
Molecular FormulaC11H13FN2O2
Molecular Weight224.24 g/mol
Exact Mass224.10
IUPAC Name2-(7-fluoro-2H-1,5-naphthyridin-1-yl)-1-methoxyethanol
SMILESCOC(O)CN1CC=Cc2ncc(F)cc21
InChIInChI=1S/C11H13FN2O2/c1-16-11(15)7-14-4-2-3-9-10(14)5-8(12)6-13-9/h2-3,5-6,11,15H,4,7H2,1H3
InChIKeyZRHJNSNKSIKGAA-UHFFFAOYSA-N
XLogP1.02
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.24
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(7-fluoro-2H-1,5-naphthyridin-1-yl)-1-methoxyethanol?
The IUPAC name of 2-(7-fluoro-2H-1,5-naphthyridin-1-yl)-1-methoxyethanol (CID 141190550) is 2-(7-fluoro-2H-1,5-naphthyridin-1-yl)-1-methoxyethanol.
What is the SMILES notation for 2-(7-fluoro-2H-1,5-naphthyridin-1-yl)-1-methoxyethanol?
The canonical SMILES for 2-(7-fluoro-2H-1,5-naphthyridin-1-yl)-1-methoxyethanol is COC(O)CN1CC=Cc2ncc(F)cc21.
What is the InChIKey of 2-(7-fluoro-2H-1,5-naphthyridin-1-yl)-1-methoxyethanol?
The InChIKey is ZRHJNSNKSIKGAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2O2/c1-16-11(15)7-14-4-2-3-9-10(14)5-8(12)6-13-9/h2-3,5-6,11,15H,4,7H2,1H3.
What are the key properties of 2-(7-fluoro-2H-1,5-naphthyridin-1-yl)-1-methoxyethanol?
2-(7-fluoro-2H-1,5-naphthyridin-1-yl)-1-methoxyethanol has a molecular weight of 224.24 g/mol, XLogP of 1.02, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-fluoro-2H-1,5-naphthyridin-1-yl)-1-methoxyethanol is sourced from PubChem (CID 141190550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).