1,3-dihydropyrrolo[3,4-c]pyridin-2-amine

C7H9N3 — CID 89418615

IUPAC1,3-dihydropyrrolo[3,4-c]pyridin-2-amine
SMILESNN1Cc2ccncc2C1
InChIInChI=1S/C7H9N3/c8-10-4-6-1-2-9-3-7(6)5-10/h1-3H,4-5,8H2
InChIKeyVTGIQPVNAZMENQ-UHFFFAOYSA-N
MW135.17 g/mol
LogP0.27
Rot. Bonds

About 1,3-dihydropyrrolo[3,4-c]pyridin-2-amine

1,3-dihydropyrrolo[3,4-c]pyridin-2-amine (PubChem CID 89418615) has the molecular formula C7H9N3 and a molecular weight of 135.17 g/mol. Its IUPAC name is 1,3-dihydropyrrolo[3,4-c]pyridin-2-amine.

Molecular Properties

Compound Name1,3-dihydropyrrolo[3,4-c]pyridin-2-amine
PubChem CID89418615
Molecular FormulaC7H9N3
Molecular Weight135.17 g/mol
Exact Mass135.08
IUPAC Name1,3-dihydropyrrolo[3,4-c]pyridin-2-amine
SMILESNN1Cc2ccncc2C1
InChIInChI=1S/C7H9N3/c8-10-4-6-1-2-9-3-7(6)5-10/h1-3H,4-5,8H2
InChIKeyVTGIQPVNAZMENQ-UHFFFAOYSA-N
XLogP0.27
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.17
LogP ≤ 50.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,3-dihydropyrrolo[3,4-c]pyridin-2-amine?
The IUPAC name of 1,3-dihydropyrrolo[3,4-c]pyridin-2-amine (CID 89418615) is 1,3-dihydropyrrolo[3,4-c]pyridin-2-amine.
What is the SMILES notation for 1,3-dihydropyrrolo[3,4-c]pyridin-2-amine?
The canonical SMILES for 1,3-dihydropyrrolo[3,4-c]pyridin-2-amine is NN1Cc2ccncc2C1.
What is the InChIKey of 1,3-dihydropyrrolo[3,4-c]pyridin-2-amine?
The InChIKey is VTGIQPVNAZMENQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3/c8-10-4-6-1-2-9-3-7(6)5-10/h1-3H,4-5,8H2.
What are the key properties of 1,3-dihydropyrrolo[3,4-c]pyridin-2-amine?
1,3-dihydropyrrolo[3,4-c]pyridin-2-amine has a molecular weight of 135.17 g/mol, XLogP of 0.27, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dihydropyrrolo[3,4-c]pyridin-2-amine is sourced from PubChem (CID 89418615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).