4-hydroxy-1,3,6-trimethyl-1,5-naphthyridin-2-one

C11H12N2O2 — CID 70883655

IUPAC4-hydroxy-1,3,6-trimethyl-1,5-naphthyridin-2-one
SMILESCc1ccc2c(n1)c(O)c(C)c(=O)n2C
InChIInChI=1S/C11H12N2O2/c1-6-4-5-8-9(12-6)10(14)7(2)11(15)13(8)3/h4-5,14H,1-3H3
InChIKeyMSHRNDXEKCHZTJ-UHFFFAOYSA-N
MW204.23 g/mol
LogP1.26
Rot. Bonds

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

4-hydroxy-1,3,6-trimethyl-1,5-naphthyridin-2-one (PubChem CID 70883655) has the molecular formula C11H12N2O2 and a molecular weight of 204.23 g/mol. Its IUPAC name is 4-hydroxy-1,3,6-trimethyl-1,5-naphthyridin-2-one.

Molecular Properties

Compound Name4-hydroxy-1,3,6-trimethyl-1,5-naphthyridin-2-one
PubChem CID70883655
Molecular FormulaC11H12N2O2
Molecular Weight204.23 g/mol
Exact Mass204.09
IUPAC Name4-hydroxy-1,3,6-trimethyl-1,5-naphthyridin-2-one
SMILESCc1ccc2c(n1)c(O)c(C)c(=O)n2C
InChIInChI=1S/C11H12N2O2/c1-6-4-5-8-9(12-6)10(14)7(2)11(15)13(8)3/h4-5,14H,1-3H3
InChIKeyMSHRNDXEKCHZTJ-UHFFFAOYSA-N
XLogP1.26
TPSA55.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-1,3,6-trimethyl-1,5-naphthyridin-2-one?
The IUPAC name of 4-hydroxy-1,3,6-trimethyl-1,5-naphthyridin-2-one (CID 70883655) is 4-hydroxy-1,3,6-trimethyl-1,5-naphthyridin-2-one.
What is the SMILES notation for 4-hydroxy-1,3,6-trimethyl-1,5-naphthyridin-2-one?
The canonical SMILES for 4-hydroxy-1,3,6-trimethyl-1,5-naphthyridin-2-one is Cc1ccc2c(n1)c(O)c(C)c(=O)n2C.
What is the InChIKey of 4-hydroxy-1,3,6-trimethyl-1,5-naphthyridin-2-one?
The InChIKey is MSHRNDXEKCHZTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2/c1-6-4-5-8-9(12-6)10(14)7(2)11(15)13(8)3/h4-5,14H,1-3H3.
What are the key properties of 4-hydroxy-1,3,6-trimethyl-1,5-naphthyridin-2-one?
4-hydroxy-1,3,6-trimethyl-1,5-naphthyridin-2-one has a molecular weight of 204.23 g/mol, XLogP of 1.26, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-1,3,6-trimethyl-1,5-naphthyridin-2-one is sourced from PubChem (CID 70883655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).