2-ethyl-4,4-difluoro-6,7-dihydro-5H-pyrazolo[1,5-a]pyridine

C9H12F2N2 — CID 168880318

IUPAC2-ethyl-4,4-difluoro-6,7-dihydro-5H-pyrazolo[1,5-a]pyridine
SMILESCCc1cc2n(n1)CCCC2(F)F
InChIInChI=1S/C9H12F2N2/c1-2-7-6-8-9(10,11)4-3-5-13(8)12-7/h6H,2-5H2,1H3
InChIKeyCVYPZPBAKWELJO-UHFFFAOYSA-N
MW186.20 g/mol
LogP2.33
Rot. Bonds1

About 2-ethyl-4,4-difluoro-6,7-dihydro-5H-pyrazolo[1,5-a]pyridine

2-ethyl-4,4-difluoro-6,7-dihydro-5H-pyrazolo[1,5-a]pyridine (PubChem CID 168880318) has the molecular formula C9H12F2N2 and a molecular weight of 186.20 g/mol. Its IUPAC name is 2-ethyl-4,4-difluoro-6,7-dihydro-5H-pyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name2-ethyl-4,4-difluoro-6,7-dihydro-5H-pyrazolo[1,5-a]pyridine
PubChem CID168880318
Molecular FormulaC9H12F2N2
Molecular Weight186.20 g/mol
Exact Mass186.10
IUPAC Name2-ethyl-4,4-difluoro-6,7-dihydro-5H-pyrazolo[1,5-a]pyridine
SMILESCCc1cc2n(n1)CCCC2(F)F
InChIInChI=1S/C9H12F2N2/c1-2-7-6-8-9(10,11)4-3-5-13(8)12-7/h6H,2-5H2,1H3
InChIKeyCVYPZPBAKWELJO-UHFFFAOYSA-N
XLogP2.33
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.20
LogP ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4,4-difluoro-6,7-dihydro-5H-pyrazolo[1,5-a]pyridine?
The IUPAC name of 2-ethyl-4,4-difluoro-6,7-dihydro-5H-pyrazolo[1,5-a]pyridine (CID 168880318) is 2-ethyl-4,4-difluoro-6,7-dihydro-5H-pyrazolo[1,5-a]pyridine.
What is the SMILES notation for 2-ethyl-4,4-difluoro-6,7-dihydro-5H-pyrazolo[1,5-a]pyridine?
The canonical SMILES for 2-ethyl-4,4-difluoro-6,7-dihydro-5H-pyrazolo[1,5-a]pyridine is CCc1cc2n(n1)CCCC2(F)F.
What is the InChIKey of 2-ethyl-4,4-difluoro-6,7-dihydro-5H-pyrazolo[1,5-a]pyridine?
The InChIKey is CVYPZPBAKWELJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12F2N2/c1-2-7-6-8-9(10,11)4-3-5-13(8)12-7/h6H,2-5H2,1H3.
What are the key properties of 2-ethyl-4,4-difluoro-6,7-dihydro-5H-pyrazolo[1,5-a]pyridine?
2-ethyl-4,4-difluoro-6,7-dihydro-5H-pyrazolo[1,5-a]pyridine has a molecular weight of 186.20 g/mol, XLogP of 2.33, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4,4-difluoro-6,7-dihydro-5H-pyrazolo[1,5-a]pyridine is sourced from PubChem (CID 168880318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).