4,7-dimethyl-6H-pyrano[3,2-c]pyridine-2,5-dione

C10H9NO3 — CID 705319

IUPAC4,7-dimethyl-6H-pyrano[3,2-c]pyridine-2,5-dione
SMILESCc1cc2oc(=O)cc(C)c2c(=O)[nH]1
InChIInChI=1S/C10H9NO3/c1-5-3-8(12)14-7-4-6(2)11-10(13)9(5)7/h3-4H,1-2H3,(H,11,13)
InChIKeyTWDXOJOBVIGEOK-UHFFFAOYSA-N
MW191.19 g/mol
LogP1.10
Rot. Bonds

About 4,7-dimethyl-6H-pyrano[3,2-c]pyridine-2,5-dione

4,7-dimethyl-6H-pyrano[3,2-c]pyridine-2,5-dione (PubChem CID 705319) has the molecular formula C10H9NO3 and a molecular weight of 191.19 g/mol. Its IUPAC name is 4,7-dimethyl-6H-pyrano[3,2-c]pyridine-2,5-dione.

Molecular Properties

Compound Name4,7-dimethyl-6H-pyrano[3,2-c]pyridine-2,5-dione
PubChem CID705319
Molecular FormulaC10H9NO3
Molecular Weight191.19 g/mol
Exact Mass191.06
IUPAC Name4,7-dimethyl-6H-pyrano[3,2-c]pyridine-2,5-dione
SMILESCc1cc2oc(=O)cc(C)c2c(=O)[nH]1
InChIInChI=1S/C10H9NO3/c1-5-3-8(12)14-7-4-6(2)11-10(13)9(5)7/h3-4H,1-2H3,(H,11,13)
InChIKeyTWDXOJOBVIGEOK-UHFFFAOYSA-N
XLogP1.10
TPSA63.07 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.19
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4,7-dimethyl-6H-pyrano[3,2-c]pyridine-2,5-dione?
The IUPAC name of 4,7-dimethyl-6H-pyrano[3,2-c]pyridine-2,5-dione (CID 705319) is 4,7-dimethyl-6H-pyrano[3,2-c]pyridine-2,5-dione.
What is the SMILES notation for 4,7-dimethyl-6H-pyrano[3,2-c]pyridine-2,5-dione?
The canonical SMILES for 4,7-dimethyl-6H-pyrano[3,2-c]pyridine-2,5-dione is Cc1cc2oc(=O)cc(C)c2c(=O)[nH]1.
What is the InChIKey of 4,7-dimethyl-6H-pyrano[3,2-c]pyridine-2,5-dione?
The InChIKey is TWDXOJOBVIGEOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO3/c1-5-3-8(12)14-7-4-6(2)11-10(13)9(5)7/h3-4H,1-2H3,(H,11,13).
What are the key properties of 4,7-dimethyl-6H-pyrano[3,2-c]pyridine-2,5-dione?
4,7-dimethyl-6H-pyrano[3,2-c]pyridine-2,5-dione has a molecular weight of 191.19 g/mol, XLogP of 1.10, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,7-dimethyl-6H-pyrano[3,2-c]pyridine-2,5-dione is sourced from PubChem (CID 705319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).