4,5,6,7-tetrahydro-1H-pyrrolo[2,3-b]pyridine

C7H10N2 — CID 55286411

IUPAC4,5,6,7-tetrahydro-1H-pyrrolo[2,3-b]pyridine
SMILESc1cc2c([nH]1)NCCC2
InChIInChI=1S/C7H10N2/c1-2-6-3-5-9-7(6)8-4-1/h3,5,8-9H,1-2,4H2
InChIKeyREPGMMMMEXASST-UHFFFAOYSA-N
MW122.17 g/mol
LogP1.37
Rot. Bonds

About 4,5,6,7-tetrahydro-1H-pyrrolo[2,3-b]pyridine

4,5,6,7-tetrahydro-1H-pyrrolo[2,3-b]pyridine (PubChem CID 55286411) has the molecular formula C7H10N2 and a molecular weight of 122.17 g/mol. Its IUPAC name is 4,5,6,7-tetrahydro-1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name4,5,6,7-tetrahydro-1H-pyrrolo[2,3-b]pyridine
PubChem CID55286411
Molecular FormulaC7H10N2
Molecular Weight122.17 g/mol
Exact Mass122.08
IUPAC Name4,5,6,7-tetrahydro-1H-pyrrolo[2,3-b]pyridine
SMILESc1cc2c([nH]1)NCCC2
InChIInChI=1S/C7H10N2/c1-2-6-3-5-9-7(6)8-4-1/h3,5,8-9H,1-2,4H2
InChIKeyREPGMMMMEXASST-UHFFFAOYSA-N
XLogP1.37
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.17
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 4,5,6,7-tetrahydro-1H-pyrrolo[2,3-b]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 4,5,6,7-tetrahydro-1H-pyrrolo[2,3-b]pyridine?
The IUPAC name of 4,5,6,7-tetrahydro-1H-pyrrolo[2,3-b]pyridine (CID 55286411) is 4,5,6,7-tetrahydro-1H-pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 4,5,6,7-tetrahydro-1H-pyrrolo[2,3-b]pyridine?
The canonical SMILES for 4,5,6,7-tetrahydro-1H-pyrrolo[2,3-b]pyridine is c1cc2c([nH]1)NCCC2.
What is the InChIKey of 4,5,6,7-tetrahydro-1H-pyrrolo[2,3-b]pyridine?
The InChIKey is REPGMMMMEXASST-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2/c1-2-6-3-5-9-7(6)8-4-1/h3,5,8-9H,1-2,4H2.
What are the key properties of 4,5,6,7-tetrahydro-1H-pyrrolo[2,3-b]pyridine?
4,5,6,7-tetrahydro-1H-pyrrolo[2,3-b]pyridine has a molecular weight of 122.17 g/mol, XLogP of 1.37, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5,6,7-tetrahydro-1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 55286411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).