3-methyl-4H-pyrano[2,3-c]pyridine

C9H9NO — CID 123693196

IUPAC3-methyl-4H-pyrano[2,3-c]pyridine
SMILESCC1=COc2cnccc2C1
InChIInChI=1S/C9H9NO/c1-7-4-8-2-3-10-5-9(8)11-6-7/h2-3,5-6H,4H2,1H3
InChIKeyVECGJEBICMIJFZ-UHFFFAOYSA-N
MW147.18 g/mol
LogP1.92
Rot. Bonds

About 3-methyl-4H-pyrano[2,3-c]pyridine

3-methyl-4H-pyrano[2,3-c]pyridine (PubChem CID 123693196) has the molecular formula C9H9NO and a molecular weight of 147.18 g/mol. Its IUPAC name is 3-methyl-4H-pyrano[2,3-c]pyridine.

Molecular Properties

Compound Name3-methyl-4H-pyrano[2,3-c]pyridine
PubChem CID123693196
Molecular FormulaC9H9NO
Molecular Weight147.18 g/mol
Exact Mass147.07
IUPAC Name3-methyl-4H-pyrano[2,3-c]pyridine
SMILESCC1=COc2cnccc2C1
InChIInChI=1S/C9H9NO/c1-7-4-8-2-3-10-5-9(8)11-6-7/h2-3,5-6H,4H2,1H3
InChIKeyVECGJEBICMIJFZ-UHFFFAOYSA-N
XLogP1.92
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.18
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-4H-pyrano[2,3-c]pyridine?
The IUPAC name of 3-methyl-4H-pyrano[2,3-c]pyridine (CID 123693196) is 3-methyl-4H-pyrano[2,3-c]pyridine.
What is the SMILES notation for 3-methyl-4H-pyrano[2,3-c]pyridine?
The canonical SMILES for 3-methyl-4H-pyrano[2,3-c]pyridine is CC1=COc2cnccc2C1.
What is the InChIKey of 3-methyl-4H-pyrano[2,3-c]pyridine?
The InChIKey is VECGJEBICMIJFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9NO/c1-7-4-8-2-3-10-5-9(8)11-6-7/h2-3,5-6H,4H2,1H3.
What are the key properties of 3-methyl-4H-pyrano[2,3-c]pyridine?
3-methyl-4H-pyrano[2,3-c]pyridine has a molecular weight of 147.18 g/mol, XLogP of 1.92, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4H-pyrano[2,3-c]pyridine is sourced from PubChem (CID 123693196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).