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

C8H9NO — CID 67903894

IUPAC2,3-dihydro-1H-pyrano[3,4-b]pyridine
SMILESC1=CC2=CCCNC2=CO1
InChIInChI=1S/C8H9NO/c1-2-7-3-5-10-6-8(7)9-4-1/h2-3,5-6,9H,1,4H2
InChIKeyLOLJWGYXTFDDMJ-UHFFFAOYSA-N
MW135.17 g/mol
LogP1.29
Rot. Bonds

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

2,3-dihydro-1H-pyrano[3,4-b]pyridine (PubChem CID 67903894) has the molecular formula C8H9NO and a molecular weight of 135.17 g/mol. Its IUPAC name is 2,3-dihydro-1H-pyrano[3,4-b]pyridine.

Molecular Properties

Compound Name2,3-dihydro-1H-pyrano[3,4-b]pyridine
PubChem CID67903894
Molecular FormulaC8H9NO
Molecular Weight135.17 g/mol
Exact Mass135.07
IUPAC Name2,3-dihydro-1H-pyrano[3,4-b]pyridine
SMILESC1=CC2=CCCNC2=CO1
InChIInChI=1S/C8H9NO/c1-2-7-3-5-10-6-8(7)9-4-1/h2-3,5-6,9H,1,4H2
InChIKeyLOLJWGYXTFDDMJ-UHFFFAOYSA-N
XLogP1.29
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.17
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-pyrano[3,4-b]pyridine?
The IUPAC name of 2,3-dihydro-1H-pyrano[3,4-b]pyridine (CID 67903894) is 2,3-dihydro-1H-pyrano[3,4-b]pyridine.
What is the SMILES notation for 2,3-dihydro-1H-pyrano[3,4-b]pyridine?
The canonical SMILES for 2,3-dihydro-1H-pyrano[3,4-b]pyridine is C1=CC2=CCCNC2=CO1.
What is the InChIKey of 2,3-dihydro-1H-pyrano[3,4-b]pyridine?
The InChIKey is LOLJWGYXTFDDMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO/c1-2-7-3-5-10-6-8(7)9-4-1/h2-3,5-6,9H,1,4H2.
What are the key properties of 2,3-dihydro-1H-pyrano[3,4-b]pyridine?
2,3-dihydro-1H-pyrano[3,4-b]pyridine has a molecular weight of 135.17 g/mol, XLogP of 1.29, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-pyrano[3,4-b]pyridine is sourced from PubChem (CID 67903894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).