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

C10H11N3 — CID 58970177

IUPAC1-(azetidin-3-yl)pyrrolo[3,2-b]pyridine
SMILESc1cnc2ccn(C3CNC3)c2c1
InChIInChI=1S/C10H11N3/c1-2-10-9(12-4-1)3-5-13(10)8-6-11-7-8/h1-5,8,11H,6-7H2
InChIKeyXCHMVMXRXWPDPK-UHFFFAOYSA-N
MW173.22 g/mol
LogP1.18
Rot. Bonds1

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

1-(azetidin-3-yl)pyrrolo[3,2-b]pyridine (PubChem CID 58970177) has the molecular formula C10H11N3 and a molecular weight of 173.22 g/mol. Its IUPAC name is 1-(azetidin-3-yl)pyrrolo[3,2-b]pyridine.

Molecular Properties

Compound Name1-(azetidin-3-yl)pyrrolo[3,2-b]pyridine
PubChem CID58970177
Molecular FormulaC10H11N3
Molecular Weight173.22 g/mol
Exact Mass173.10
IUPAC Name1-(azetidin-3-yl)pyrrolo[3,2-b]pyridine
SMILESc1cnc2ccn(C3CNC3)c2c1
InChIInChI=1S/C10H11N3/c1-2-10-9(12-4-1)3-5-13(10)8-6-11-7-8/h1-5,8,11H,6-7H2
InChIKeyXCHMVMXRXWPDPK-UHFFFAOYSA-N
XLogP1.18
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.22
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(azetidin-3-yl)pyrrolo[3,2-b]pyridine?
The IUPAC name of 1-(azetidin-3-yl)pyrrolo[3,2-b]pyridine (CID 58970177) is 1-(azetidin-3-yl)pyrrolo[3,2-b]pyridine.
What is the SMILES notation for 1-(azetidin-3-yl)pyrrolo[3,2-b]pyridine?
The canonical SMILES for 1-(azetidin-3-yl)pyrrolo[3,2-b]pyridine is c1cnc2ccn(C3CNC3)c2c1.
What is the InChIKey of 1-(azetidin-3-yl)pyrrolo[3,2-b]pyridine?
The InChIKey is XCHMVMXRXWPDPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3/c1-2-10-9(12-4-1)3-5-13(10)8-6-11-7-8/h1-5,8,11H,6-7H2.
What are the key properties of 1-(azetidin-3-yl)pyrrolo[3,2-b]pyridine?
1-(azetidin-3-yl)pyrrolo[3,2-b]pyridine has a molecular weight of 173.22 g/mol, XLogP of 1.18, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(azetidin-3-yl)pyrrolo[3,2-b]pyridine is sourced from PubChem (CID 58970177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).