4-hydroxy-6-methyl-1H-1,5-naphthyridin-2-one

C9H8N2O2 — CID 54689168

IUPAC4-hydroxy-6-methyl-1H-1,5-naphthyridin-2-one
SMILESCc1ccc2[nH]c(=O)cc(O)c2n1
InChIInChI=1S/C9H8N2O2/c1-5-2-3-6-9(10-5)7(12)4-8(13)11-6/h2-4H,1H3,(H2,11,12,13)
InChIKeyHWDWMVZVQUPPEP-UHFFFAOYSA-N
MW176.17 g/mol
LogP0.94
Rot. Bonds

About 4-hydroxy-6-methyl-1H-1,5-naphthyridin-2-one

4-hydroxy-6-methyl-1H-1,5-naphthyridin-2-one (PubChem CID 54689168) has the molecular formula C9H8N2O2 and a molecular weight of 176.17 g/mol. Its IUPAC name is 4-hydroxy-6-methyl-1H-1,5-naphthyridin-2-one.

Molecular Properties

Compound Name4-hydroxy-6-methyl-1H-1,5-naphthyridin-2-one
PubChem CID54689168
Molecular FormulaC9H8N2O2
Molecular Weight176.17 g/mol
Exact Mass176.06
IUPAC Name4-hydroxy-6-methyl-1H-1,5-naphthyridin-2-one
SMILESCc1ccc2[nH]c(=O)cc(O)c2n1
InChIInChI=1S/C9H8N2O2/c1-5-2-3-6-9(10-5)7(12)4-8(13)11-6/h2-4H,1H3,(H2,11,12,13)
InChIKeyHWDWMVZVQUPPEP-UHFFFAOYSA-N
XLogP0.94
TPSA65.98 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.17
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-6-methyl-1H-1,5-naphthyridin-2-one?
The IUPAC name of 4-hydroxy-6-methyl-1H-1,5-naphthyridin-2-one (CID 54689168) is 4-hydroxy-6-methyl-1H-1,5-naphthyridin-2-one.
What is the SMILES notation for 4-hydroxy-6-methyl-1H-1,5-naphthyridin-2-one?
The canonical SMILES for 4-hydroxy-6-methyl-1H-1,5-naphthyridin-2-one is Cc1ccc2[nH]c(=O)cc(O)c2n1.
What is the InChIKey of 4-hydroxy-6-methyl-1H-1,5-naphthyridin-2-one?
The InChIKey is HWDWMVZVQUPPEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2O2/c1-5-2-3-6-9(10-5)7(12)4-8(13)11-6/h2-4H,1H3,(H2,11,12,13).
What are the key properties of 4-hydroxy-6-methyl-1H-1,5-naphthyridin-2-one?
4-hydroxy-6-methyl-1H-1,5-naphthyridin-2-one has a molecular weight of 176.17 g/mol, XLogP of 0.94, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-6-methyl-1H-1,5-naphthyridin-2-one is sourced from PubChem (CID 54689168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).