3aH-pyrrolo[2,3-c]pyridine

C7H6N2 — CID 20778925

IUPAC3aH-pyrrolo[2,3-c]pyridine
SMILESC1=CC2C=CN=C2C=N1
InChIInChI=1S/C7H6N2/c1-3-8-5-7-6(1)2-4-9-7/h1-6H
InChIKeyCVCLOIRQFOEMCV-UHFFFAOYSA-N
MW118.14 g/mol
LogP1.17
Rot. Bonds

About 3aH-pyrrolo[2,3-c]pyridine

3aH-pyrrolo[2,3-c]pyridine (PubChem CID 20778925) has the molecular formula C7H6N2 and a molecular weight of 118.14 g/mol. Its IUPAC name is 3aH-pyrrolo[2,3-c]pyridine.

Molecular Properties

Compound Name3aH-pyrrolo[2,3-c]pyridine
PubChem CID20778925
Molecular FormulaC7H6N2
Molecular Weight118.14 g/mol
Exact Mass118.05
IUPAC Name3aH-pyrrolo[2,3-c]pyridine
SMILESC1=CC2C=CN=C2C=N1
InChIInChI=1S/C7H6N2/c1-3-8-5-7-6(1)2-4-9-7/h1-6H
InChIKeyCVCLOIRQFOEMCV-UHFFFAOYSA-N
XLogP1.17
TPSA24.72 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 ≤ 51.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3aH-pyrrolo[2,3-c]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3aH-pyrrolo[2,3-c]pyridine?
The IUPAC name of 3aH-pyrrolo[2,3-c]pyridine (CID 20778925) is 3aH-pyrrolo[2,3-c]pyridine.
What is the SMILES notation for 3aH-pyrrolo[2,3-c]pyridine?
The canonical SMILES for 3aH-pyrrolo[2,3-c]pyridine is C1=CC2C=CN=C2C=N1.
What is the InChIKey of 3aH-pyrrolo[2,3-c]pyridine?
The InChIKey is CVCLOIRQFOEMCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2/c1-3-8-5-7-6(1)2-4-9-7/h1-6H.
What are the key properties of 3aH-pyrrolo[2,3-c]pyridine?
3aH-pyrrolo[2,3-c]pyridine has a molecular weight of 118.14 g/mol, XLogP of 1.17, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3aH-pyrrolo[2,3-c]pyridine is sourced from PubChem (CID 20778925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).