2H-pyrrolo[3,2-b]pyridine

C7H6N2 — CID 56972322

IUPAC2H-pyrrolo[3,2-b]pyridine
SMILESC1=c2ncccc2=NC1
InChIInChI=1S/C7H6N2/c1-2-6-7(8-4-1)3-5-9-6/h1-4H,5H2
InChIKeyFQZLUNNSILEMNS-UHFFFAOYSA-N
MW118.14 g/mol
LogP-0.50
Rot. Bonds

About 2H-pyrrolo[3,2-b]pyridine

2H-pyrrolo[3,2-b]pyridine (PubChem CID 56972322) has the molecular formula C7H6N2 and a molecular weight of 118.14 g/mol. Its IUPAC name is 2H-pyrrolo[3,2-b]pyridine.

Molecular Properties

Compound Name2H-pyrrolo[3,2-b]pyridine
PubChem CID56972322
Molecular FormulaC7H6N2
Molecular Weight118.14 g/mol
Exact Mass118.05
IUPAC Name2H-pyrrolo[3,2-b]pyridine
SMILESC1=c2ncccc2=NC1
InChIInChI=1S/C7H6N2/c1-2-6-7(8-4-1)3-5-9-6/h1-4H,5H2
InChIKeyFQZLUNNSILEMNS-UHFFFAOYSA-N
XLogP-0.50
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.14
LogP ≤ 5-0.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2H-pyrrolo[3,2-b]pyridine?
The IUPAC name of 2H-pyrrolo[3,2-b]pyridine (CID 56972322) is 2H-pyrrolo[3,2-b]pyridine.
What is the SMILES notation for 2H-pyrrolo[3,2-b]pyridine?
The canonical SMILES for 2H-pyrrolo[3,2-b]pyridine is C1=c2ncccc2=NC1.
What is the InChIKey of 2H-pyrrolo[3,2-b]pyridine?
The InChIKey is FQZLUNNSILEMNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2/c1-2-6-7(8-4-1)3-5-9-6/h1-4H,5H2.
What are the key properties of 2H-pyrrolo[3,2-b]pyridine?
2H-pyrrolo[3,2-b]pyridine has a molecular weight of 118.14 g/mol, XLogP of -0.50, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2H-pyrrolo[3,2-b]pyridine is sourced from PubChem (CID 56972322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).