5,6-dihydro-1H-pyrrolo[2,3-b]pyridine

C7H8N2 — CID 70639991

IUPAC5,6-dihydro-1H-pyrrolo[2,3-b]pyridine
SMILESC1=c2cc[nH]c2=NCC1
InChIInChI=1S/C7H8N2/c1-2-6-3-5-9-7(6)8-4-1/h2-3,5H,1,4H2,(H,8,9)
InChIKeyRXUMYDHGPCRYRT-UHFFFAOYSA-N
MW120.15 g/mol
LogP-0.18
Rot. Bonds

About 5,6-dihydro-1H-pyrrolo[2,3-b]pyridine

5,6-dihydro-1H-pyrrolo[2,3-b]pyridine (PubChem CID 70639991) has the molecular formula C7H8N2 and a molecular weight of 120.15 g/mol. Its IUPAC name is 5,6-dihydro-1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name5,6-dihydro-1H-pyrrolo[2,3-b]pyridine
PubChem CID70639991
Molecular FormulaC7H8N2
Molecular Weight120.15 g/mol
Exact Mass120.07
IUPAC Name5,6-dihydro-1H-pyrrolo[2,3-b]pyridine
SMILESC1=c2cc[nH]c2=NCC1
InChIInChI=1S/C7H8N2/c1-2-6-3-5-9-7(6)8-4-1/h2-3,5H,1,4H2,(H,8,9)
InChIKeyRXUMYDHGPCRYRT-UHFFFAOYSA-N
XLogP-0.18
TPSA28.15 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.15
LogP ≤ 5-0.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5,6-dihydro-1H-pyrrolo[2,3-b]pyridine?
The IUPAC name of 5,6-dihydro-1H-pyrrolo[2,3-b]pyridine (CID 70639991) is 5,6-dihydro-1H-pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 5,6-dihydro-1H-pyrrolo[2,3-b]pyridine?
The canonical SMILES for 5,6-dihydro-1H-pyrrolo[2,3-b]pyridine is C1=c2cc[nH]c2=NCC1.
What is the InChIKey of 5,6-dihydro-1H-pyrrolo[2,3-b]pyridine?
The InChIKey is RXUMYDHGPCRYRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2/c1-2-6-3-5-9-7(6)8-4-1/h2-3,5H,1,4H2,(H,8,9).
What are the key properties of 5,6-dihydro-1H-pyrrolo[2,3-b]pyridine?
5,6-dihydro-1H-pyrrolo[2,3-b]pyridine has a molecular weight of 120.15 g/mol, XLogP of -0.18, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dihydro-1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 70639991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).