3,6-dimethyl-2H-pyrano[3,2-b]pyridine

C10H11NO — CID 143545346

IUPAC3,6-dimethyl-2H-pyrano[3,2-b]pyridine
SMILESCC1=Cc2nc(C)ccc2OC1
InChIInChI=1S/C10H11NO/c1-7-5-9-10(12-6-7)4-3-8(2)11-9/h3-5H,6H2,1-2H3
InChIKeyRFZXVXKBNOLNBL-UHFFFAOYSA-N
MW161.20 g/mol
LogP2.19
Rot. Bonds

About 3,6-dimethyl-2H-pyrano[3,2-b]pyridine

3,6-dimethyl-2H-pyrano[3,2-b]pyridine (PubChem CID 143545346) has the molecular formula C10H11NO and a molecular weight of 161.20 g/mol. Its IUPAC name is 3,6-dimethyl-2H-pyrano[3,2-b]pyridine.

Molecular Properties

Compound Name3,6-dimethyl-2H-pyrano[3,2-b]pyridine
PubChem CID143545346
Molecular FormulaC10H11NO
Molecular Weight161.20 g/mol
Exact Mass161.08
IUPAC Name3,6-dimethyl-2H-pyrano[3,2-b]pyridine
SMILESCC1=Cc2nc(C)ccc2OC1
InChIInChI=1S/C10H11NO/c1-7-5-9-10(12-6-7)4-3-8(2)11-9/h3-5H,6H2,1-2H3
InChIKeyRFZXVXKBNOLNBL-UHFFFAOYSA-N
XLogP2.19
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,6-dimethyl-2H-pyrano[3,2-b]pyridine?
The IUPAC name of 3,6-dimethyl-2H-pyrano[3,2-b]pyridine (CID 143545346) is 3,6-dimethyl-2H-pyrano[3,2-b]pyridine.
What is the SMILES notation for 3,6-dimethyl-2H-pyrano[3,2-b]pyridine?
The canonical SMILES for 3,6-dimethyl-2H-pyrano[3,2-b]pyridine is CC1=Cc2nc(C)ccc2OC1.
What is the InChIKey of 3,6-dimethyl-2H-pyrano[3,2-b]pyridine?
The InChIKey is RFZXVXKBNOLNBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO/c1-7-5-9-10(12-6-7)4-3-8(2)11-9/h3-5H,6H2,1-2H3.
What are the key properties of 3,6-dimethyl-2H-pyrano[3,2-b]pyridine?
3,6-dimethyl-2H-pyrano[3,2-b]pyridine has a molecular weight of 161.20 g/mol, XLogP of 2.19, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dimethyl-2H-pyrano[3,2-b]pyridine is sourced from PubChem (CID 143545346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).