6,7-dihydropyrrolo[2,3-c]pyridin-5-imine

C7H7N3 — CID 176535434

IUPAC6,7-dihydropyrrolo[2,3-c]pyridin-5-imine
SMILES[H]/N=C1\C=C2C=CN=C2CN1
InChIInChI=1S/C7H7N3/c8-7-3-5-1-2-9-6(5)4-10-7/h1-3H,4H2,(H2,8,10)
InChIKeyQVJXIVKDDHTZDD-UHFFFAOYSA-N
MW133.15 g/mol
LogP0.46
Rot. Bonds

About 6,7-dihydropyrrolo[2,3-c]pyridin-5-imine

6,7-dihydropyrrolo[2,3-c]pyridin-5-imine (PubChem CID 176535434) has the molecular formula C7H7N3 and a molecular weight of 133.15 g/mol. Its IUPAC name is 6,7-dihydropyrrolo[2,3-c]pyridin-5-imine.

Molecular Properties

Compound Name6,7-dihydropyrrolo[2,3-c]pyridin-5-imine
PubChem CID176535434
Molecular FormulaC7H7N3
Molecular Weight133.15 g/mol
Exact Mass133.06
IUPAC Name6,7-dihydropyrrolo[2,3-c]pyridin-5-imine
SMILES[H]/N=C1\C=C2C=CN=C2CN1
InChIInChI=1S/C7H7N3/c8-7-3-5-1-2-9-6(5)4-10-7/h1-3H,4H2,(H2,8,10)
InChIKeyQVJXIVKDDHTZDD-UHFFFAOYSA-N
XLogP0.46
TPSA48.24 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.15
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6,7-dihydropyrrolo[2,3-c]pyridin-5-imine?
The IUPAC name of 6,7-dihydropyrrolo[2,3-c]pyridin-5-imine (CID 176535434) is 6,7-dihydropyrrolo[2,3-c]pyridin-5-imine.
What is the SMILES notation for 6,7-dihydropyrrolo[2,3-c]pyridin-5-imine?
The canonical SMILES for 6,7-dihydropyrrolo[2,3-c]pyridin-5-imine is [H]/N=C1\C=C2C=CN=C2CN1.
What is the InChIKey of 6,7-dihydropyrrolo[2,3-c]pyridin-5-imine?
The InChIKey is QVJXIVKDDHTZDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3/c8-7-3-5-1-2-9-6(5)4-10-7/h1-3H,4H2,(H2,8,10).
What are the key properties of 6,7-dihydropyrrolo[2,3-c]pyridin-5-imine?
6,7-dihydropyrrolo[2,3-c]pyridin-5-imine has a molecular weight of 133.15 g/mol, XLogP of 0.46, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dihydropyrrolo[2,3-c]pyridin-5-imine is sourced from PubChem (CID 176535434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).