6-(3-azidoprop-1-enyl)-1H-pyrazolo[4,5-b]pyridine

C9H8N6 — CID 169461887

IUPAC6-(3-azidoprop-1-enyl)-1H-pyrazolo[4,5-b]pyridine
SMILES[N-]=[N+]=NCC=Cc1cnc2cn[nH]c2c1
InChIInChI=1S/C9H8N6/c10-15-12-3-1-2-7-4-8-9(11-5-7)6-13-14-8/h1-2,4-6H,3H2,(H,13,14)
InChIKeySDKDCCHEDVIBEW-UHFFFAOYSA-N
MW200.21 g/mol
LogP2.28
Rot. Bonds3

About 6-(3-azidoprop-1-enyl)-1H-pyrazolo[4,5-b]pyridine

6-(3-azidoprop-1-enyl)-1H-pyrazolo[4,5-b]pyridine (PubChem CID 169461887) has the molecular formula C9H8N6 and a molecular weight of 200.21 g/mol. Its IUPAC name is 6-(3-azidoprop-1-enyl)-1H-pyrazolo[4,5-b]pyridine.

Molecular Properties

Compound Name6-(3-azidoprop-1-enyl)-1H-pyrazolo[4,5-b]pyridine
PubChem CID169461887
Molecular FormulaC9H8N6
Molecular Weight200.21 g/mol
Exact Mass200.08
IUPAC Name6-(3-azidoprop-1-enyl)-1H-pyrazolo[4,5-b]pyridine
SMILES[N-]=[N+]=NCC=Cc1cnc2cn[nH]c2c1
InChIInChI=1S/C9H8N6/c10-15-12-3-1-2-7-4-8-9(11-5-7)6-13-14-8/h1-2,4-6H,3H2,(H,13,14)
InChIKeySDKDCCHEDVIBEW-UHFFFAOYSA-N
XLogP2.28
TPSA90.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.21
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Related Compounds

6-(3-chloroprop-1-enyl)-1H-pyrazolo[4,5-b]pyridine
CID 169477478
4-(1H-pyrazolo[4,5-b]pyridin-6-yl)but-3-enal
CID 170482011
5-(3-azidoprop-1-enyl)-2-methylpyridin-3-amine
CID 169461419
4-(3-azidoprop-1-enyl)-1H-indazole
CID 169461875
4-(3-azidoprop-1-enyl)-1H-pyrazol-5-amine
CID 169461227
5-(3-azidoprop-1-enyl)pyridin-3-ol
CID 169461299
5-(4-azidobut-1-enyl)-1H-pyrazolo[5,4-b]pyridine
CID 170485417
6-(3-azidoprop-1-enyl)-3H-[1,3]oxazolo[4,5-b]pyridin-2-one
CID 169461911
5-(3-azidoprop-1-enyl)-2-fluoropyridine
CID 169461269
5-(3-azidoprop-1-enyl)-3-nitropyridin-2-amine
CID 169462186
[5-(3-azidoprop-1-enyl)-2-pyridinyl]methanol
CID 169461523
5-(3-azidoprop-1-enyl)-1H-indole
CID 169461878

Frequently Asked Questions

What is the IUPAC name of 6-(3-azidoprop-1-enyl)-1H-pyrazolo[4,5-b]pyridine?
The IUPAC name of 6-(3-azidoprop-1-enyl)-1H-pyrazolo[4,5-b]pyridine (CID 169461887) is 6-(3-azidoprop-1-enyl)-1H-pyrazolo[4,5-b]pyridine.
What is the SMILES notation for 6-(3-azidoprop-1-enyl)-1H-pyrazolo[4,5-b]pyridine?
The canonical SMILES for 6-(3-azidoprop-1-enyl)-1H-pyrazolo[4,5-b]pyridine is [N-]=[N+]=NCC=Cc1cnc2cn[nH]c2c1.
What is the InChIKey of 6-(3-azidoprop-1-enyl)-1H-pyrazolo[4,5-b]pyridine?
The InChIKey is SDKDCCHEDVIBEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N6/c10-15-12-3-1-2-7-4-8-9(11-5-7)6-13-14-8/h1-2,4-6H,3H2,(H,13,14).
What are the key properties of 6-(3-azidoprop-1-enyl)-1H-pyrazolo[4,5-b]pyridine?
6-(3-azidoprop-1-enyl)-1H-pyrazolo[4,5-b]pyridine has a molecular weight of 200.21 g/mol, XLogP of 2.28, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-azidoprop-1-enyl)-1H-pyrazolo[4,5-b]pyridine is sourced from PubChem (CID 169461887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).