2-methyl-[1]benzofuro[3,2-d][1,3]oxazin-4-one

C11H7NO3 — CID 647478

IUPAC2-methyl-[1]benzofuro[3,2-d][1,3]oxazin-4-one
SMILESCc1nc2c(oc3ccccc32)c(=O)o1
InChIInChI=1S/C11H7NO3/c1-6-12-9-7-4-2-3-5-8(7)15-10(9)11(13)14-6/h2-5H,1H3
InChIKeyUMUUTEZBWGDVDA-UHFFFAOYSA-N
MW201.18 g/mol
LogP2.24
Rot. Bonds

About 2-methyl-[1]benzofuro[3,2-d][1,3]oxazin-4-one

2-methyl-[1]benzofuro[3,2-d][1,3]oxazin-4-one (PubChem CID 647478) has the molecular formula C11H7NO3 and a molecular weight of 201.18 g/mol. Its IUPAC name is 2-methyl-[1]benzofuro[3,2-d][1,3]oxazin-4-one.

Molecular Properties

Compound Name2-methyl-[1]benzofuro[3,2-d][1,3]oxazin-4-one
PubChem CID647478
Molecular FormulaC11H7NO3
Molecular Weight201.18 g/mol
Exact Mass201.04
IUPAC Name2-methyl-[1]benzofuro[3,2-d][1,3]oxazin-4-one
SMILESCc1nc2c(oc3ccccc32)c(=O)o1
InChIInChI=1S/C11H7NO3/c1-6-12-9-7-4-2-3-5-8(7)15-10(9)11(13)14-6/h2-5H,1H3
InChIKeyUMUUTEZBWGDVDA-UHFFFAOYSA-N
XLogP2.24
TPSA56.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.18
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-[1]benzofuro[3,2-d][1,3]oxazin-4-one?
The IUPAC name of 2-methyl-[1]benzofuro[3,2-d][1,3]oxazin-4-one (CID 647478) is 2-methyl-[1]benzofuro[3,2-d][1,3]oxazin-4-one.
What is the SMILES notation for 2-methyl-[1]benzofuro[3,2-d][1,3]oxazin-4-one?
The canonical SMILES for 2-methyl-[1]benzofuro[3,2-d][1,3]oxazin-4-one is Cc1nc2c(oc3ccccc32)c(=O)o1.
What is the InChIKey of 2-methyl-[1]benzofuro[3,2-d][1,3]oxazin-4-one?
The InChIKey is UMUUTEZBWGDVDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7NO3/c1-6-12-9-7-4-2-3-5-8(7)15-10(9)11(13)14-6/h2-5H,1H3.
What are the key properties of 2-methyl-[1]benzofuro[3,2-d][1,3]oxazin-4-one?
2-methyl-[1]benzofuro[3,2-d][1,3]oxazin-4-one has a molecular weight of 201.18 g/mol, XLogP of 2.24, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-[1]benzofuro[3,2-d][1,3]oxazin-4-one is sourced from PubChem (CID 647478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).