4-ethyl-7-iodo-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine

C10H8F3IN2 — CID 59389393

IUPAC4-ethyl-7-iodo-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine
SMILESCCc1ccc(I)n2nc(C(F)(F)F)cc12
InChIInChI=1S/C10H8F3IN2/c1-2-6-3-4-9(14)16-7(6)5-8(15-16)10(11,12)13/h3-5H,2H2,1H3
InChIKeyOGCMJSWEPMDPES-UHFFFAOYSA-N
MW340.09 g/mol
LogP3.52
Rot. Bonds1

About 4-ethyl-7-iodo-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine

4-ethyl-7-iodo-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine (PubChem CID 59389393) has the molecular formula C10H8F3IN2 and a molecular weight of 340.09 g/mol. Its IUPAC name is 4-ethyl-7-iodo-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name4-ethyl-7-iodo-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine
PubChem CID59389393
Molecular FormulaC10H8F3IN2
Molecular Weight340.09 g/mol
Exact Mass339.97
IUPAC Name4-ethyl-7-iodo-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine
SMILESCCc1ccc(I)n2nc(C(F)(F)F)cc12
InChIInChI=1S/C10H8F3IN2/c1-2-6-3-4-9(14)16-7(6)5-8(15-16)10(11,12)13/h3-5H,2H2,1H3
InChIKeyOGCMJSWEPMDPES-UHFFFAOYSA-N
XLogP3.52
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.09
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

1,5-Diphenyl-3-trifluoromethyl-1H-pyrazole
CID 10424186
3-methyl-1-phenyl-1H-indazole
CID 11367779
1-phenyl-3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazole
CID 2760581
1,3-Diphenyl-5-trifluoromethyl-1H-pyrazole
CID 11140750
2-(difluoromethyl)-3-iodo-2H-indazole
CID 135039813
2-Fluoro-3-(trifluoromethyl)pyrazolo[1,5-a]pyridine
CID 332941
2,3-Bis(trifluoromethyl)pyrazolo[1,5-a]pyridine
CID 12777793
3,5-Dimethyl-1-phenyl-4-(trifluoromethyl)pyrazole
CID 57385177
5-Methyl-3-phenyl-1-(trifluoromethyl)pyrazole
CID 57997080
7-Trifluoromethylpyrazolo[1,5-a]pyridine
CID 123269739
3,5-dimethyl-1-[4-(trifluoromethyl)phenyl]-1H-pyrazole
CID 2740504
3,4,7-trimethyl-2-(3-(trifluoromethyl)phenyl)-2H-pyrazolo[3,4-d]pyridazine
CID 17635131

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-7-iodo-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine?
The IUPAC name of 4-ethyl-7-iodo-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine (CID 59389393) is 4-ethyl-7-iodo-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine.
What is the SMILES notation for 4-ethyl-7-iodo-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine?
The canonical SMILES for 4-ethyl-7-iodo-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine is CCc1ccc(I)n2nc(C(F)(F)F)cc12.
What is the InChIKey of 4-ethyl-7-iodo-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine?
The InChIKey is OGCMJSWEPMDPES-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8F3IN2/c1-2-6-3-4-9(14)16-7(6)5-8(15-16)10(11,12)13/h3-5H,2H2,1H3.
What are the key properties of 4-ethyl-7-iodo-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine?
4-ethyl-7-iodo-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine has a molecular weight of 340.09 g/mol, XLogP of 3.52, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-7-iodo-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine is sourced from PubChem (CID 59389393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).