2-methyl-2-phenyl-6H-pyrano[3,2-c]pyridin-5-one

C15H13NO2 — CID 135069095

IUPAC2-methyl-2-phenyl-6H-pyrano[3,2-c]pyridin-5-one
SMILESCC1(c2ccccc2)C=Cc2c(cc[nH]c2=O)O1
InChIInChI=1S/C15H13NO2/c1-15(11-5-3-2-4-6-11)9-7-12-13(18-15)8-10-16-14(12)17/h2-10H,1H3,(H,16,17)
InChIKeyLOVMGTHXFIPPPE-UHFFFAOYSA-N
MW239.27 g/mol
LogP2.70
Rot. Bonds1

About 2-methyl-2-phenyl-6H-pyrano[3,2-c]pyridin-5-one

2-methyl-2-phenyl-6H-pyrano[3,2-c]pyridin-5-one (PubChem CID 135069095) has the molecular formula C15H13NO2 and a molecular weight of 239.27 g/mol. Its IUPAC name is 2-methyl-2-phenyl-6H-pyrano[3,2-c]pyridin-5-one.

Molecular Properties

Compound Name2-methyl-2-phenyl-6H-pyrano[3,2-c]pyridin-5-one
PubChem CID135069095
Molecular FormulaC15H13NO2
Molecular Weight239.27 g/mol
Exact Mass239.09
IUPAC Name2-methyl-2-phenyl-6H-pyrano[3,2-c]pyridin-5-one
SMILESCC1(c2ccccc2)C=Cc2c(cc[nH]c2=O)O1
InChIInChI=1S/C15H13NO2/c1-15(11-5-3-2-4-6-11)9-7-12-13(18-15)8-10-16-14(12)17/h2-10H,1H3,(H,16,17)
InChIKeyLOVMGTHXFIPPPE-UHFFFAOYSA-N
XLogP2.70
TPSA42.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-phenyl-6H-pyrano[3,2-c]pyridin-5-one?
The IUPAC name of 2-methyl-2-phenyl-6H-pyrano[3,2-c]pyridin-5-one (CID 135069095) is 2-methyl-2-phenyl-6H-pyrano[3,2-c]pyridin-5-one.
What is the SMILES notation for 2-methyl-2-phenyl-6H-pyrano[3,2-c]pyridin-5-one?
The canonical SMILES for 2-methyl-2-phenyl-6H-pyrano[3,2-c]pyridin-5-one is CC1(c2ccccc2)C=Cc2c(cc[nH]c2=O)O1.
What is the InChIKey of 2-methyl-2-phenyl-6H-pyrano[3,2-c]pyridin-5-one?
The InChIKey is LOVMGTHXFIPPPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO2/c1-15(11-5-3-2-4-6-11)9-7-12-13(18-15)8-10-16-14(12)17/h2-10H,1H3,(H,16,17).
What are the key properties of 2-methyl-2-phenyl-6H-pyrano[3,2-c]pyridin-5-one?
2-methyl-2-phenyl-6H-pyrano[3,2-c]pyridin-5-one has a molecular weight of 239.27 g/mol, XLogP of 2.70, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-phenyl-6H-pyrano[3,2-c]pyridin-5-one is sourced from PubChem (CID 135069095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).