5-methyl-6-phenyl-3-pyridin-2-yl-[1,2]oxazolo[4,5-c]pyridin-4-one

C18H13N3O2 — CID 23579324

IUPAC5-methyl-6-phenyl-3-pyridin-2-yl-[1,2]oxazolo[4,5-c]pyridin-4-one
SMILESCn1c(-c2ccccc2)cc2onc(-c3ccccn3)c2c1=O
InChIInChI=1S/C18H13N3O2/c1-21-14(12-7-3-2-4-8-12)11-15-16(18(21)22)17(20-23-15)13-9-5-6-10-19-13/h2-11H,1H3
InChIKeyGIIFHMOHLHHYCT-UHFFFAOYSA-N
MW303.32 g/mol
LogP3.26
Rot. Bonds2

About 5-methyl-6-phenyl-3-pyridin-2-yl-[1,2]oxazolo[4,5-c]pyridin-4-one

5-methyl-6-phenyl-3-pyridin-2-yl-[1,2]oxazolo[4,5-c]pyridin-4-one (PubChem CID 23579324) has the molecular formula C18H13N3O2 and a molecular weight of 303.32 g/mol. Its IUPAC name is 5-methyl-6-phenyl-3-pyridin-2-yl-[1,2]oxazolo[4,5-c]pyridin-4-one.

Molecular Properties

Compound Name5-methyl-6-phenyl-3-pyridin-2-yl-[1,2]oxazolo[4,5-c]pyridin-4-one
PubChem CID23579324
Molecular FormulaC18H13N3O2
Molecular Weight303.32 g/mol
Exact Mass303.10
IUPAC Name5-methyl-6-phenyl-3-pyridin-2-yl-[1,2]oxazolo[4,5-c]pyridin-4-one
SMILESCn1c(-c2ccccc2)cc2onc(-c3ccccn3)c2c1=O
InChIInChI=1S/C18H13N3O2/c1-21-14(12-7-3-2-4-8-12)11-15-16(18(21)22)17(20-23-15)13-9-5-6-10-19-13/h2-11H,1H3
InChIKeyGIIFHMOHLHHYCT-UHFFFAOYSA-N
XLogP3.26
TPSA60.92 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.32
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-6-phenyl-3-pyridin-2-yl-[1,2]oxazolo[4,5-c]pyridin-4-one?
The IUPAC name of 5-methyl-6-phenyl-3-pyridin-2-yl-[1,2]oxazolo[4,5-c]pyridin-4-one (CID 23579324) is 5-methyl-6-phenyl-3-pyridin-2-yl-[1,2]oxazolo[4,5-c]pyridin-4-one.
What is the SMILES notation for 5-methyl-6-phenyl-3-pyridin-2-yl-[1,2]oxazolo[4,5-c]pyridin-4-one?
The canonical SMILES for 5-methyl-6-phenyl-3-pyridin-2-yl-[1,2]oxazolo[4,5-c]pyridin-4-one is Cn1c(-c2ccccc2)cc2onc(-c3ccccn3)c2c1=O.
What is the InChIKey of 5-methyl-6-phenyl-3-pyridin-2-yl-[1,2]oxazolo[4,5-c]pyridin-4-one?
The InChIKey is GIIFHMOHLHHYCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13N3O2/c1-21-14(12-7-3-2-4-8-12)11-15-16(18(21)22)17(20-23-15)13-9-5-6-10-19-13/h2-11H,1H3.
What are the key properties of 5-methyl-6-phenyl-3-pyridin-2-yl-[1,2]oxazolo[4,5-c]pyridin-4-one?
5-methyl-6-phenyl-3-pyridin-2-yl-[1,2]oxazolo[4,5-c]pyridin-4-one has a molecular weight of 303.32 g/mol, XLogP of 3.26, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-6-phenyl-3-pyridin-2-yl-[1,2]oxazolo[4,5-c]pyridin-4-one is sourced from PubChem (CID 23579324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).