2-(azidomethyl)-4-fluoro-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine

C8H10FN5 — CID 162349449

IUPAC2-(azidomethyl)-4-fluoro-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
SMILES[N-]=[N+]=NCc1cc2n(n1)CCCC2F
InChIInChI=1S/C8H10FN5/c9-7-2-1-3-14-8(7)4-6(12-14)5-11-13-10/h4,7H,1-3,5H2
InChIKeyZRFZLCQIVFWISB-UHFFFAOYSA-N
MW195.20 g/mol
LogP2.50
Rot. Bonds2

About 2-(azidomethyl)-4-fluoro-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine

2-(azidomethyl)-4-fluoro-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine (PubChem CID 162349449) has the molecular formula C8H10FN5 and a molecular weight of 195.20 g/mol. Its IUPAC name is 2-(azidomethyl)-4-fluoro-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name2-(azidomethyl)-4-fluoro-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
PubChem CID162349449
Molecular FormulaC8H10FN5
Molecular Weight195.20 g/mol
Exact Mass195.09
IUPAC Name2-(azidomethyl)-4-fluoro-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
SMILES[N-]=[N+]=NCc1cc2n(n1)CCCC2F
InChIInChI=1S/C8H10FN5/c9-7-2-1-3-14-8(7)4-6(12-14)5-11-13-10/h4,7H,1-3,5H2
InChIKeyZRFZLCQIVFWISB-UHFFFAOYSA-N
XLogP2.50
TPSA66.58 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.20
LogP ≤ 52.50
H-Bond Donors ≤ 50
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

4H,5H,6H,7H-pyrazolo(1,5-a)pyridine
CID 13785278
Dipropyl-(4,5,6,7-tetrahydro-pyrazolo[1,5-a]pyridin-5-yl)-amine
CID 11356479
Dipropyl-(S)-4,5,6,7-tetrahydro-pyrazolo[1,5-a]pyridin-5-yl-amine
CID 11615489
Dipropyl-(R)-4,5,6,7-tetrahydro-pyrazolo[1,5-a]pyridin-5-yl-amine
CID 11708363
4,5,6,7-Tetrahydro-2-(trifluoromethyl)-pyrazolo(1,5-a)pyrazine
CID 54775461
2-(chloromethyl)-4H,5H,6H,7H-pyrazolo(1,5-a)pyridine
CID 68793761
2-cyclopropyl-4H,5H,6H,7H-pyrazolo[1,5-a]pyrazine hydrochloride
CID 132286794
2-bromo-4H,5H,6H,7H-pyrazolo[1,5-a]pyridine
CID 105453277
1-{4H,5H,6H,7H-pyrazolo[1,5-a]pyridin-2-yl}ethan-1-amine dihydrochloride
CID 122149390
(4H,5H,6H,7H-pyrazolo(1,5-a)pyridin-2-yl)methanamine dihydrochloride
CID 122156683
5-(cyclohexen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carbonitrile
CID 129619401
5-Butyl-1-(1,1,1,3,3,3-hexafluoropropan-2-yl)-3-(trifluoromethyl)pyrazole
CID 21724083

Frequently Asked Questions

What is the IUPAC name of 2-(azidomethyl)-4-fluoro-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine?
The IUPAC name of 2-(azidomethyl)-4-fluoro-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine (CID 162349449) is 2-(azidomethyl)-4-fluoro-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine.
What is the SMILES notation for 2-(azidomethyl)-4-fluoro-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine?
The canonical SMILES for 2-(azidomethyl)-4-fluoro-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine is [N-]=[N+]=NCc1cc2n(n1)CCCC2F.
What is the InChIKey of 2-(azidomethyl)-4-fluoro-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine?
The InChIKey is ZRFZLCQIVFWISB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FN5/c9-7-2-1-3-14-8(7)4-6(12-14)5-11-13-10/h4,7H,1-3,5H2.
What are the key properties of 2-(azidomethyl)-4-fluoro-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine?
2-(azidomethyl)-4-fluoro-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine has a molecular weight of 195.20 g/mol, XLogP of 2.50, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azidomethyl)-4-fluoro-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine is sourced from PubChem (CID 162349449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).