2,3-dihydro-1H-pyrano[3,4-b]pyridine-4,6-dione

C8H7NO3 — CID 161138308

IUPAC2,3-dihydro-1H-pyrano[3,4-b]pyridine-4,6-dione
SMILESO=C1CCNc2coc(=O)cc21
InChIInChI=1S/C8H7NO3/c10-7-1-2-9-6-4-12-8(11)3-5(6)7/h3-4,9H,1-2H2
InChIKeyUNCBKWDNIXLPAE-UHFFFAOYSA-N
MW165.15 g/mol
LogP0.64
Rot. Bonds

About 2,3-dihydro-1H-pyrano[3,4-b]pyridine-4,6-dione

2,3-dihydro-1H-pyrano[3,4-b]pyridine-4,6-dione (PubChem CID 161138308) has the molecular formula C8H7NO3 and a molecular weight of 165.15 g/mol. Its IUPAC name is 2,3-dihydro-1H-pyrano[3,4-b]pyridine-4,6-dione.

Molecular Properties

Compound Name2,3-dihydro-1H-pyrano[3,4-b]pyridine-4,6-dione
PubChem CID161138308
Molecular FormulaC8H7NO3
Molecular Weight165.15 g/mol
Exact Mass165.04
IUPAC Name2,3-dihydro-1H-pyrano[3,4-b]pyridine-4,6-dione
SMILESO=C1CCNc2coc(=O)cc21
InChIInChI=1S/C8H7NO3/c10-7-1-2-9-6-4-12-8(11)3-5(6)7/h3-4,9H,1-2H2
InChIKeyUNCBKWDNIXLPAE-UHFFFAOYSA-N
XLogP0.64
TPSA59.31 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.15
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6,7-dimethyl-2,3-dihydro-1H-quinolin-4-one
CID 82276023
4-oxo-2,3-dihydro-1H-quinoline-6-carbaldehyde
CID 82411274
6-ethynyl-2,3-dihydro-1H-quinolin-4-one
CID 147341621
2,3-dihydro-1H-quinolin-4-one;ethane
CID 91530065
6-(trifluoromethoxy)-2,3-dihydro-1H-quinolin-4-one
CID 15550363
7-(hydroxymethyl)-2,3-dihydro-1H-quinolin-4-one
CID 130038975
2-bromo-6,7-dihydro-5H-furo[2,3-b]pyridin-4-one
CID 96611333
8-chloro-2,3,4,5-tetrahydro-1H-1-benzazocin-6-one
CID 142567432
5,6,7,8-tetrahydroisochromen-3-one
CID 14293006
2,3-dihydro-1H-quinolin-4-one;2-hydroxypropanoic acid
CID 175847816
1,2,3,4,5,6-hexahydro-1-benzazonin-7-one
CID 121011436
8-methyl-1,2,3,4-tetrahydro-1-benzazepin-5-one
CID 45098257

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-pyrano[3,4-b]pyridine-4,6-dione?
The IUPAC name of 2,3-dihydro-1H-pyrano[3,4-b]pyridine-4,6-dione (CID 161138308) is 2,3-dihydro-1H-pyrano[3,4-b]pyridine-4,6-dione.
What is the SMILES notation for 2,3-dihydro-1H-pyrano[3,4-b]pyridine-4,6-dione?
The canonical SMILES for 2,3-dihydro-1H-pyrano[3,4-b]pyridine-4,6-dione is O=C1CCNc2coc(=O)cc21.
What is the InChIKey of 2,3-dihydro-1H-pyrano[3,4-b]pyridine-4,6-dione?
The InChIKey is UNCBKWDNIXLPAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7NO3/c10-7-1-2-9-6-4-12-8(11)3-5(6)7/h3-4,9H,1-2H2.
What are the key properties of 2,3-dihydro-1H-pyrano[3,4-b]pyridine-4,6-dione?
2,3-dihydro-1H-pyrano[3,4-b]pyridine-4,6-dione has a molecular weight of 165.15 g/mol, XLogP of 0.64, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-pyrano[3,4-b]pyridine-4,6-dione is sourced from PubChem (CID 161138308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).