5-[6-(difluoromethoxy)pyrazolo[1,5-a]pyridin-7-yl]thiophene-2-carbaldehyde

C13H8F2N2O2S — CID 178134388

IUPAC5-[6-(difluoromethoxy)pyrazolo[1,5-a]pyridin-7-yl]thiophene-2-carbaldehyde
SMILESO=Cc1ccc(-c2c(OC(F)F)ccc3ccnn23)s1
InChIInChI=1S/C13H8F2N2O2S/c14-13(15)19-10-3-1-8-5-6-16-17(8)12(10)11-4-2-9(7-18)20-11/h1-7,13H
InChIKeySPUZQFUBKZBPRA-UHFFFAOYSA-N
MW294.28 g/mol
LogP3.48
Rot. Bonds4

About 5-[6-(difluoromethoxy)pyrazolo[1,5-a]pyridin-7-yl]thiophene-2-carbaldehyde

5-[6-(difluoromethoxy)pyrazolo[1,5-a]pyridin-7-yl]thiophene-2-carbaldehyde (PubChem CID 178134388) has the molecular formula C13H8F2N2O2S and a molecular weight of 294.28 g/mol. Its IUPAC name is 5-[6-(difluoromethoxy)pyrazolo[1,5-a]pyridin-7-yl]thiophene-2-carbaldehyde.

Molecular Properties

Compound Name5-[6-(difluoromethoxy)pyrazolo[1,5-a]pyridin-7-yl]thiophene-2-carbaldehyde
PubChem CID178134388
Molecular FormulaC13H8F2N2O2S
Molecular Weight294.28 g/mol
Exact Mass294.03
IUPAC Name5-[6-(difluoromethoxy)pyrazolo[1,5-a]pyridin-7-yl]thiophene-2-carbaldehyde
SMILESO=Cc1ccc(-c2c(OC(F)F)ccc3ccnn23)s1
InChIInChI=1S/C13H8F2N2O2S/c14-13(15)19-10-3-1-8-5-6-16-17(8)12(10)11-4-2-9(7-18)20-11/h1-7,13H
InChIKeySPUZQFUBKZBPRA-UHFFFAOYSA-N
XLogP3.48
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.28
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

6-Methoxy-7-(3,3,3-trifluoropropyl)pyrazolo[1,5-a]pyridine-3-carbaldehyde
CID 166773524
5-[3-(Trifluoromethoxy)-2-pyridinyl]thiophene-2-carbaldehyde
CID 178133806
5-[3-(2,2-Difluoroethoxy)-2-pyridinyl]thiophene-2-carbaldehyde
CID 178133947
5-[5-(Difluoromethoxy)pyrazolo[1,5-a]pyridin-6-yl]thiophene-2-carbaldehyde
CID 178133976
5-[3-(Difluoromethoxy)-2-pyridinyl]thiophene-2-carbaldehyde
CID 178134020
5-[3-(2,2,2-Trifluoroethoxy)-2-pyridinyl]thiophene-2-carbaldehyde
CID 178134082
4-(4-Methoxy-6-phenylpyrazolo[1,5-a]pyridin-3-yl)thiophene-2-carboxamide
CID 58385873
5-(3-Methoxypyridin-2-yl)thiophene-2-carbaldehyde
CID 164648722
5-(5-Methoxypyrazolo[1,5-a]pyridin-6-yl)thiophene-2-carbaldehyde
CID 178132878
5-(6-Methoxypyrazolo[1,5-a]pyridin-7-yl)thiophene-2-carbaldehyde
CID 178134352

Frequently Asked Questions

What is the IUPAC name of 5-[6-(difluoromethoxy)pyrazolo[1,5-a]pyridin-7-yl]thiophene-2-carbaldehyde?
The IUPAC name of 5-[6-(difluoromethoxy)pyrazolo[1,5-a]pyridin-7-yl]thiophene-2-carbaldehyde (CID 178134388) is 5-[6-(difluoromethoxy)pyrazolo[1,5-a]pyridin-7-yl]thiophene-2-carbaldehyde.
What is the SMILES notation for 5-[6-(difluoromethoxy)pyrazolo[1,5-a]pyridin-7-yl]thiophene-2-carbaldehyde?
The canonical SMILES for 5-[6-(difluoromethoxy)pyrazolo[1,5-a]pyridin-7-yl]thiophene-2-carbaldehyde is O=Cc1ccc(-c2c(OC(F)F)ccc3ccnn23)s1.
What is the InChIKey of 5-[6-(difluoromethoxy)pyrazolo[1,5-a]pyridin-7-yl]thiophene-2-carbaldehyde?
The InChIKey is SPUZQFUBKZBPRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8F2N2O2S/c14-13(15)19-10-3-1-8-5-6-16-17(8)12(10)11-4-2-9(7-18)20-11/h1-7,13H.
What are the key properties of 5-[6-(difluoromethoxy)pyrazolo[1,5-a]pyridin-7-yl]thiophene-2-carbaldehyde?
5-[6-(difluoromethoxy)pyrazolo[1,5-a]pyridin-7-yl]thiophene-2-carbaldehyde has a molecular weight of 294.28 g/mol, XLogP of 3.48, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[6-(difluoromethoxy)pyrazolo[1,5-a]pyridin-7-yl]thiophene-2-carbaldehyde is sourced from PubChem (CID 178134388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).