4-hydroxy-7,8-dimethyl-6-phenylpyrano[3,2-c]pyridine-2,5-dione

C16H13NO4 — CID 54705955

IUPAC4-hydroxy-7,8-dimethyl-6-phenylpyrano[3,2-c]pyridine-2,5-dione
SMILESCc1c(C)n(-c2ccccc2)c(=O)c2c(O)cc(=O)oc12
InChIInChI=1S/C16H13NO4/c1-9-10(2)17(11-6-4-3-5-7-11)16(20)14-12(18)8-13(19)21-15(9)14/h3-8,18H,1-2H3
InChIKeyLGCDCPPWOMNREN-UHFFFAOYSA-N
MW283.28 g/mol
LogP2.27
Rot. Bonds1

About 4-hydroxy-7,8-dimethyl-6-phenylpyrano[3,2-c]pyridine-2,5-dione

4-hydroxy-7,8-dimethyl-6-phenylpyrano[3,2-c]pyridine-2,5-dione (PubChem CID 54705955) has the molecular formula C16H13NO4 and a molecular weight of 283.28 g/mol. Its IUPAC name is 4-hydroxy-7,8-dimethyl-6-phenylpyrano[3,2-c]pyridine-2,5-dione.

Molecular Properties

Compound Name4-hydroxy-7,8-dimethyl-6-phenylpyrano[3,2-c]pyridine-2,5-dione
PubChem CID54705955
Molecular FormulaC16H13NO4
Molecular Weight283.28 g/mol
Exact Mass283.08
IUPAC Name4-hydroxy-7,8-dimethyl-6-phenylpyrano[3,2-c]pyridine-2,5-dione
SMILESCc1c(C)n(-c2ccccc2)c(=O)c2c(O)cc(=O)oc12
InChIInChI=1S/C16H13NO4/c1-9-10(2)17(11-6-4-3-5-7-11)16(20)14-12(18)8-13(19)21-15(9)14/h3-8,18H,1-2H3
InChIKeyLGCDCPPWOMNREN-UHFFFAOYSA-N
XLogP2.27
TPSA72.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.28
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-7,8-dimethyl-6-phenylpyrano[3,2-c]pyridine-2,5-dione?
The IUPAC name of 4-hydroxy-7,8-dimethyl-6-phenylpyrano[3,2-c]pyridine-2,5-dione (CID 54705955) is 4-hydroxy-7,8-dimethyl-6-phenylpyrano[3,2-c]pyridine-2,5-dione.
What is the SMILES notation for 4-hydroxy-7,8-dimethyl-6-phenylpyrano[3,2-c]pyridine-2,5-dione?
The canonical SMILES for 4-hydroxy-7,8-dimethyl-6-phenylpyrano[3,2-c]pyridine-2,5-dione is Cc1c(C)n(-c2ccccc2)c(=O)c2c(O)cc(=O)oc12.
What is the InChIKey of 4-hydroxy-7,8-dimethyl-6-phenylpyrano[3,2-c]pyridine-2,5-dione?
The InChIKey is LGCDCPPWOMNREN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO4/c1-9-10(2)17(11-6-4-3-5-7-11)16(20)14-12(18)8-13(19)21-15(9)14/h3-8,18H,1-2H3.
What are the key properties of 4-hydroxy-7,8-dimethyl-6-phenylpyrano[3,2-c]pyridine-2,5-dione?
4-hydroxy-7,8-dimethyl-6-phenylpyrano[3,2-c]pyridine-2,5-dione has a molecular weight of 283.28 g/mol, XLogP of 2.27, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-7,8-dimethyl-6-phenylpyrano[3,2-c]pyridine-2,5-dione is sourced from PubChem (CID 54705955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).