3-(azetidin-2-yl)-1H-pyrrolo[2,3-b]pyridine

C10H11N3 — CID 55293524

IUPAC3-(azetidin-2-yl)-1H-pyrrolo[2,3-b]pyridine
SMILESc1cnc2[nH]cc(C3CCN3)c2c1
InChIInChI=1S/C10H11N3/c1-2-7-8(9-3-5-11-9)6-13-10(7)12-4-1/h1-2,4,6,9,11H,3,5H2,(H,12,13)
InChIKeyOEBFYDMYFSYBTK-UHFFFAOYSA-N
MW173.22 g/mol
LogP1.60
Rot. Bonds1

About 3-(azetidin-2-yl)-1H-pyrrolo[2,3-b]pyridine

3-(azetidin-2-yl)-1H-pyrrolo[2,3-b]pyridine (PubChem CID 55293524) has the molecular formula C10H11N3 and a molecular weight of 173.22 g/mol. Its IUPAC name is 3-(azetidin-2-yl)-1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name3-(azetidin-2-yl)-1H-pyrrolo[2,3-b]pyridine
PubChem CID55293524
Molecular FormulaC10H11N3
Molecular Weight173.22 g/mol
Exact Mass173.10
IUPAC Name3-(azetidin-2-yl)-1H-pyrrolo[2,3-b]pyridine
SMILESc1cnc2[nH]cc(C3CCN3)c2c1
InChIInChI=1S/C10H11N3/c1-2-7-8(9-3-5-11-9)6-13-10(7)12-4-1/h1-2,4,6,9,11H,3,5H2,(H,12,13)
InChIKeyOEBFYDMYFSYBTK-UHFFFAOYSA-N
XLogP1.60
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.22
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(azetidin-2-yl)-1H-pyrrolo[2,3-b]pyridine?
The IUPAC name of 3-(azetidin-2-yl)-1H-pyrrolo[2,3-b]pyridine (CID 55293524) is 3-(azetidin-2-yl)-1H-pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 3-(azetidin-2-yl)-1H-pyrrolo[2,3-b]pyridine?
The canonical SMILES for 3-(azetidin-2-yl)-1H-pyrrolo[2,3-b]pyridine is c1cnc2[nH]cc(C3CCN3)c2c1.
What is the InChIKey of 3-(azetidin-2-yl)-1H-pyrrolo[2,3-b]pyridine?
The InChIKey is OEBFYDMYFSYBTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3/c1-2-7-8(9-3-5-11-9)6-13-10(7)12-4-1/h1-2,4,6,9,11H,3,5H2,(H,12,13).
What are the key properties of 3-(azetidin-2-yl)-1H-pyrrolo[2,3-b]pyridine?
3-(azetidin-2-yl)-1H-pyrrolo[2,3-b]pyridine has a molecular weight of 173.22 g/mol, XLogP of 1.60, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(azetidin-2-yl)-1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 55293524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).