4-fluoro-7-(hydroxymethyl)-3-methyl-1H-1,5-naphthyridin-2-one

C10H9FN2O2 — CID 168984354

IUPAC4-fluoro-7-(hydroxymethyl)-3-methyl-1H-1,5-naphthyridin-2-one
SMILESCc1c(F)c2ncc(CO)cc2[nH]c1=O
InChIInChI=1S/C10H9FN2O2/c1-5-8(11)9-7(13-10(5)15)2-6(4-14)3-12-9/h2-3,14H,4H2,1H3,(H,13,15)
InChIKeyMGNSPXVNYSTSLI-UHFFFAOYSA-N
MW208.19 g/mol
LogP0.86
Rot. Bonds1

About 4-fluoro-7-(hydroxymethyl)-3-methyl-1H-1,5-naphthyridin-2-one

4-fluoro-7-(hydroxymethyl)-3-methyl-1H-1,5-naphthyridin-2-one (PubChem CID 168984354) has the molecular formula C10H9FN2O2 and a molecular weight of 208.19 g/mol. Its IUPAC name is 4-fluoro-7-(hydroxymethyl)-3-methyl-1H-1,5-naphthyridin-2-one.

Molecular Properties

Compound Name4-fluoro-7-(hydroxymethyl)-3-methyl-1H-1,5-naphthyridin-2-one
PubChem CID168984354
Molecular FormulaC10H9FN2O2
Molecular Weight208.19 g/mol
Exact Mass208.06
IUPAC Name4-fluoro-7-(hydroxymethyl)-3-methyl-1H-1,5-naphthyridin-2-one
SMILESCc1c(F)c2ncc(CO)cc2[nH]c1=O
InChIInChI=1S/C10H9FN2O2/c1-5-8(11)9-7(13-10(5)15)2-6(4-14)3-12-9/h2-3,14H,4H2,1H3,(H,13,15)
InChIKeyMGNSPXVNYSTSLI-UHFFFAOYSA-N
XLogP0.86
TPSA65.98 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.19
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-fluoro-7-(hydroxymethyl)-3-methyl-1H-1,5-naphthyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-7-(hydroxymethyl)-3-methyl-1H-1,5-naphthyridin-2-one?
The IUPAC name of 4-fluoro-7-(hydroxymethyl)-3-methyl-1H-1,5-naphthyridin-2-one (CID 168984354) is 4-fluoro-7-(hydroxymethyl)-3-methyl-1H-1,5-naphthyridin-2-one.
What is the SMILES notation for 4-fluoro-7-(hydroxymethyl)-3-methyl-1H-1,5-naphthyridin-2-one?
The canonical SMILES for 4-fluoro-7-(hydroxymethyl)-3-methyl-1H-1,5-naphthyridin-2-one is Cc1c(F)c2ncc(CO)cc2[nH]c1=O.
What is the InChIKey of 4-fluoro-7-(hydroxymethyl)-3-methyl-1H-1,5-naphthyridin-2-one?
The InChIKey is MGNSPXVNYSTSLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2O2/c1-5-8(11)9-7(13-10(5)15)2-6(4-14)3-12-9/h2-3,14H,4H2,1H3,(H,13,15).
What are the key properties of 4-fluoro-7-(hydroxymethyl)-3-methyl-1H-1,5-naphthyridin-2-one?
4-fluoro-7-(hydroxymethyl)-3-methyl-1H-1,5-naphthyridin-2-one has a molecular weight of 208.19 g/mol, XLogP of 0.86, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-7-(hydroxymethyl)-3-methyl-1H-1,5-naphthyridin-2-one is sourced from PubChem (CID 168984354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).