4-hydroxy-3,6-dimethyl-1H-1,5-naphthyridin-2-one

C10H10N2O2 — CID 89049721

IUPAC4-hydroxy-3,6-dimethyl-1H-1,5-naphthyridin-2-one
SMILESCc1ccc2[nH]c(=O)c(C)c(O)c2n1
InChIInChI=1S/C10H10N2O2/c1-5-3-4-7-8(11-5)9(13)6(2)10(14)12-7/h3-4H,1-2H3,(H2,12,13,14)
InChIKeyVWFUFCCEMGQYHZ-UHFFFAOYSA-N
MW190.20 g/mol
LogP1.25
Rot. Bonds

About 4-hydroxy-3,6-dimethyl-1H-1,5-naphthyridin-2-one

4-hydroxy-3,6-dimethyl-1H-1,5-naphthyridin-2-one (PubChem CID 89049721) has the molecular formula C10H10N2O2 and a molecular weight of 190.20 g/mol. Its IUPAC name is 4-hydroxy-3,6-dimethyl-1H-1,5-naphthyridin-2-one.

Molecular Properties

Compound Name4-hydroxy-3,6-dimethyl-1H-1,5-naphthyridin-2-one
PubChem CID89049721
Molecular FormulaC10H10N2O2
Molecular Weight190.20 g/mol
Exact Mass190.07
IUPAC Name4-hydroxy-3,6-dimethyl-1H-1,5-naphthyridin-2-one
SMILESCc1ccc2[nH]c(=O)c(C)c(O)c2n1
InChIInChI=1S/C10H10N2O2/c1-5-3-4-7-8(11-5)9(13)6(2)10(14)12-7/h3-4H,1-2H3,(H2,12,13,14)
InChIKeyVWFUFCCEMGQYHZ-UHFFFAOYSA-N
XLogP1.25
TPSA65.98 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.20
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-3,6-dimethyl-1H-1,5-naphthyridin-2-one?
The IUPAC name of 4-hydroxy-3,6-dimethyl-1H-1,5-naphthyridin-2-one (CID 89049721) is 4-hydroxy-3,6-dimethyl-1H-1,5-naphthyridin-2-one.
What is the SMILES notation for 4-hydroxy-3,6-dimethyl-1H-1,5-naphthyridin-2-one?
The canonical SMILES for 4-hydroxy-3,6-dimethyl-1H-1,5-naphthyridin-2-one is Cc1ccc2[nH]c(=O)c(C)c(O)c2n1.
What is the InChIKey of 4-hydroxy-3,6-dimethyl-1H-1,5-naphthyridin-2-one?
The InChIKey is VWFUFCCEMGQYHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2/c1-5-3-4-7-8(11-5)9(13)6(2)10(14)12-7/h3-4H,1-2H3,(H2,12,13,14).
What are the key properties of 4-hydroxy-3,6-dimethyl-1H-1,5-naphthyridin-2-one?
4-hydroxy-3,6-dimethyl-1H-1,5-naphthyridin-2-one has a molecular weight of 190.20 g/mol, XLogP of 1.25, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-3,6-dimethyl-1H-1,5-naphthyridin-2-one is sourced from PubChem (CID 89049721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).