7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine

C8H9NO2 — CID 59199637

IUPAC7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine
SMILESCc1cnc2c(c1)OCCO2
InChIInChI=1S/C8H9NO2/c1-6-4-7-8(9-5-6)11-3-2-10-7/h4-5H,2-3H2,1H3
InChIKeyLQJJDMCGUQIWME-UHFFFAOYSA-N
MW151.16 g/mol
LogP1.16
Rot. Bonds

About 7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine

7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine (PubChem CID 59199637) has the molecular formula C8H9NO2 and a molecular weight of 151.16 g/mol. Its IUPAC name is 7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine.

Molecular Properties

Compound Name7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine
PubChem CID59199637
Molecular FormulaC8H9NO2
Molecular Weight151.16 g/mol
Exact Mass151.06
IUPAC Name7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine
SMILESCc1cnc2c(c1)OCCO2
InChIInChI=1S/C8H9NO2/c1-6-4-7-8(9-5-6)11-3-2-10-7/h4-5H,2-3H2,1H3
InChIKeyLQJJDMCGUQIWME-UHFFFAOYSA-N
XLogP1.16
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.16
LogP ≤ 51.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine?
The IUPAC name of 7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine (CID 59199637) is 7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine.
What is the SMILES notation for 7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine?
The canonical SMILES for 7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine is Cc1cnc2c(c1)OCCO2.
What is the InChIKey of 7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine?
The InChIKey is LQJJDMCGUQIWME-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO2/c1-6-4-7-8(9-5-6)11-3-2-10-7/h4-5H,2-3H2,1H3.
What are the key properties of 7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine?
7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine has a molecular weight of 151.16 g/mol, XLogP of 1.16, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine is sourced from PubChem (CID 59199637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).