2-methyl-6-(3,3,3-trifluoropropoxy)pyrazolo[1,5-a]pyridine

C11H11F3N2O — CID 130229537

IUPAC2-methyl-6-(3,3,3-trifluoropropoxy)pyrazolo[1,5-a]pyridine
SMILESCc1cc2ccc(OCCC(F)(F)F)cn2n1
InChIInChI=1S/C11H11F3N2O/c1-8-6-9-2-3-10(7-16(9)15-8)17-5-4-11(12,13)14/h2-3,6-7H,4-5H2,1H3
InChIKeyVFCIVLPVSHAYFP-UHFFFAOYSA-N
MW244.22 g/mol
LogP2.97
Rot. Bonds3

About 2-methyl-6-(3,3,3-trifluoropropoxy)pyrazolo[1,5-a]pyridine

2-methyl-6-(3,3,3-trifluoropropoxy)pyrazolo[1,5-a]pyridine (PubChem CID 130229537) has the molecular formula C11H11F3N2O and a molecular weight of 244.22 g/mol. Its IUPAC name is 2-methyl-6-(3,3,3-trifluoropropoxy)pyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name2-methyl-6-(3,3,3-trifluoropropoxy)pyrazolo[1,5-a]pyridine
PubChem CID130229537
Molecular FormulaC11H11F3N2O
Molecular Weight244.22 g/mol
Exact Mass244.08
IUPAC Name2-methyl-6-(3,3,3-trifluoropropoxy)pyrazolo[1,5-a]pyridine
SMILESCc1cc2ccc(OCCC(F)(F)F)cn2n1
InChIInChI=1S/C11H11F3N2O/c1-8-6-9-2-3-10(7-16(9)15-8)17-5-4-11(12,13)14/h2-3,6-7H,4-5H2,1H3
InChIKeyVFCIVLPVSHAYFP-UHFFFAOYSA-N
XLogP2.97
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.22
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(3,3,3-trifluoropropoxy)pyrazolo[1,5-a]pyridine?
The IUPAC name of 2-methyl-6-(3,3,3-trifluoropropoxy)pyrazolo[1,5-a]pyridine (CID 130229537) is 2-methyl-6-(3,3,3-trifluoropropoxy)pyrazolo[1,5-a]pyridine.
What is the SMILES notation for 2-methyl-6-(3,3,3-trifluoropropoxy)pyrazolo[1,5-a]pyridine?
The canonical SMILES for 2-methyl-6-(3,3,3-trifluoropropoxy)pyrazolo[1,5-a]pyridine is Cc1cc2ccc(OCCC(F)(F)F)cn2n1.
What is the InChIKey of 2-methyl-6-(3,3,3-trifluoropropoxy)pyrazolo[1,5-a]pyridine?
The InChIKey is VFCIVLPVSHAYFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F3N2O/c1-8-6-9-2-3-10(7-16(9)15-8)17-5-4-11(12,13)14/h2-3,6-7H,4-5H2,1H3.
What are the key properties of 2-methyl-6-(3,3,3-trifluoropropoxy)pyrazolo[1,5-a]pyridine?
2-methyl-6-(3,3,3-trifluoropropoxy)pyrazolo[1,5-a]pyridine has a molecular weight of 244.22 g/mol, XLogP of 2.97, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(3,3,3-trifluoropropoxy)pyrazolo[1,5-a]pyridine is sourced from PubChem (CID 130229537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).