6,7-dihydro-[1]benzofuro[3,2-b]pyridine

C11H9NO — CID 121426947

IUPAC6,7-dihydro-[1]benzofuro[3,2-b]pyridine
SMILESC1=Cc2c(oc3cccnc23)CC1
InChIInChI=1S/C11H9NO/c1-2-5-9-8(4-1)11-10(13-9)6-3-7-12-11/h1,3-4,6-7H,2,5H2
InChIKeyPWQSJILYMCKKBV-UHFFFAOYSA-N
MW171.20 g/mol
LogP2.79
Rot. Bonds

About 6,7-dihydro-[1]benzofuro[3,2-b]pyridine

6,7-dihydro-[1]benzofuro[3,2-b]pyridine (PubChem CID 121426947) has the molecular formula C11H9NO and a molecular weight of 171.20 g/mol. Its IUPAC name is 6,7-dihydro-[1]benzofuro[3,2-b]pyridine.

Molecular Properties

Compound Name6,7-dihydro-[1]benzofuro[3,2-b]pyridine
PubChem CID121426947
Molecular FormulaC11H9NO
Molecular Weight171.20 g/mol
Exact Mass171.07
IUPAC Name6,7-dihydro-[1]benzofuro[3,2-b]pyridine
SMILESC1=Cc2c(oc3cccnc23)CC1
InChIInChI=1S/C11H9NO/c1-2-5-9-8(4-1)11-10(13-9)6-3-7-12-11/h1,3-4,6-7H,2,5H2
InChIKeyPWQSJILYMCKKBV-UHFFFAOYSA-N
XLogP2.79
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.20
LogP ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6,7-dihydro-[1]benzofuro[3,2-b]pyridine?
The IUPAC name of 6,7-dihydro-[1]benzofuro[3,2-b]pyridine (CID 121426947) is 6,7-dihydro-[1]benzofuro[3,2-b]pyridine.
What is the SMILES notation for 6,7-dihydro-[1]benzofuro[3,2-b]pyridine?
The canonical SMILES for 6,7-dihydro-[1]benzofuro[3,2-b]pyridine is C1=Cc2c(oc3cccnc23)CC1.
What is the InChIKey of 6,7-dihydro-[1]benzofuro[3,2-b]pyridine?
The InChIKey is PWQSJILYMCKKBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9NO/c1-2-5-9-8(4-1)11-10(13-9)6-3-7-12-11/h1,3-4,6-7H,2,5H2.
What are the key properties of 6,7-dihydro-[1]benzofuro[3,2-b]pyridine?
6,7-dihydro-[1]benzofuro[3,2-b]pyridine has a molecular weight of 171.20 g/mol, XLogP of 2.79, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dihydro-[1]benzofuro[3,2-b]pyridine is sourced from PubChem (CID 121426947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).