3aH-pyrazolo[3,4-c]pyridine

C6H5N3 — CID 152749036

IUPAC3aH-pyrazolo[3,4-c]pyridine
SMILESC1=CC2C=NN=C2C=N1
InChIInChI=1S/C6H5N3/c1-2-7-4-6-5(1)3-8-9-6/h1-5H
InChIKeyQPLKZOPIPKLHBR-UHFFFAOYSA-N
MW119.13 g/mol
LogP0.64
Rot. Bonds

About 3aH-pyrazolo[3,4-c]pyridine

3aH-pyrazolo[3,4-c]pyridine (PubChem CID 152749036) has the molecular formula C6H5N3 and a molecular weight of 119.13 g/mol. Its IUPAC name is 3aH-pyrazolo[3,4-c]pyridine.

Molecular Properties

Compound Name3aH-pyrazolo[3,4-c]pyridine
PubChem CID152749036
Molecular FormulaC6H5N3
Molecular Weight119.13 g/mol
Exact Mass119.05
IUPAC Name3aH-pyrazolo[3,4-c]pyridine
SMILESC1=CC2C=NN=C2C=N1
InChIInChI=1S/C6H5N3/c1-2-7-4-6-5(1)3-8-9-6/h1-5H
InChIKeyQPLKZOPIPKLHBR-UHFFFAOYSA-N
XLogP0.64
TPSA37.08 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.13
LogP ≤ 50.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-diazo-4H-pyridine
CID 123840381
3aH-pyrrolo[2,3-c]pyridine
CID 20778925
1-(2,3-dihydropyrrol-2-id-3-yl)-N-methanidylmethanimine;tungsten(2+)
CID 60005934
3aH-pyrrolo[2,3-d]pyridazine
CID 60005936
3aH-pyrrolo[3,4-c]pyridine
CID 67978003
7H-pyrazolo[4,3-b]pyridine
CID 76848783
3-chloro-3aH-pyrazolo[4,3-c]pyridine
CID 152183325
3aH-pyrazolo[4,3-c]pyridine
CID 152749037
3-methyl-3aH-pyrrolo[2,3-c]pyridine
CID 165375337
7-methyl-3aH-pyrazolo[3,4-c]pyridine
CID 167182575
(3aS)-3aH-pyrrolo[3,2-c]pyridine
CID 124275784
(3aR)-3aH-pyrrolo[3,2-c]pyridine
CID 124275785

Frequently Asked Questions

What is the IUPAC name of 3aH-pyrazolo[3,4-c]pyridine?
The IUPAC name of 3aH-pyrazolo[3,4-c]pyridine (CID 152749036) is 3aH-pyrazolo[3,4-c]pyridine.
What is the SMILES notation for 3aH-pyrazolo[3,4-c]pyridine?
The canonical SMILES for 3aH-pyrazolo[3,4-c]pyridine is C1=CC2C=NN=C2C=N1.
What is the InChIKey of 3aH-pyrazolo[3,4-c]pyridine?
The InChIKey is QPLKZOPIPKLHBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5N3/c1-2-7-4-6-5(1)3-8-9-6/h1-5H.
What are the key properties of 3aH-pyrazolo[3,4-c]pyridine?
3aH-pyrazolo[3,4-c]pyridine has a molecular weight of 119.13 g/mol, XLogP of 0.64, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3aH-pyrazolo[3,4-c]pyridine is sourced from PubChem (CID 152749036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).