2-methyl-6-(trifluoromethyl)-4,5-dihydropyrazolo[4,3-b]pyridine

C8H8F3N3 — CID 142401143

IUPAC2-methyl-6-(trifluoromethyl)-4,5-dihydropyrazolo[4,3-b]pyridine
SMILESCn1cc2c(n1)C=C(C(F)(F)F)CN2
InChIInChI=1S/C8H8F3N3/c1-14-4-7-6(13-14)2-5(3-12-7)8(9,10)11/h2,4,12H,3H2,1H3
InChIKeyPQPFLUGLKXRVPD-UHFFFAOYSA-N
MW203.17 g/mol
LogP1.79
Rot. Bonds

About 2-methyl-6-(trifluoromethyl)-4,5-dihydropyrazolo[4,3-b]pyridine

2-methyl-6-(trifluoromethyl)-4,5-dihydropyrazolo[4,3-b]pyridine (PubChem CID 142401143) has the molecular formula C8H8F3N3 and a molecular weight of 203.17 g/mol. Its IUPAC name is 2-methyl-6-(trifluoromethyl)-4,5-dihydropyrazolo[4,3-b]pyridine.

Molecular Properties

Compound Name2-methyl-6-(trifluoromethyl)-4,5-dihydropyrazolo[4,3-b]pyridine
PubChem CID142401143
Molecular FormulaC8H8F3N3
Molecular Weight203.17 g/mol
Exact Mass203.07
IUPAC Name2-methyl-6-(trifluoromethyl)-4,5-dihydropyrazolo[4,3-b]pyridine
SMILESCn1cc2c(n1)C=C(C(F)(F)F)CN2
InChIInChI=1S/C8H8F3N3/c1-14-4-7-6(13-14)2-5(3-12-7)8(9,10)11/h2,4,12H,3H2,1H3
InChIKeyPQPFLUGLKXRVPD-UHFFFAOYSA-N
XLogP1.79
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.17
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(trifluoromethyl)-4,5-dihydropyrazolo[4,3-b]pyridine?
The IUPAC name of 2-methyl-6-(trifluoromethyl)-4,5-dihydropyrazolo[4,3-b]pyridine (CID 142401143) is 2-methyl-6-(trifluoromethyl)-4,5-dihydropyrazolo[4,3-b]pyridine.
What is the SMILES notation for 2-methyl-6-(trifluoromethyl)-4,5-dihydropyrazolo[4,3-b]pyridine?
The canonical SMILES for 2-methyl-6-(trifluoromethyl)-4,5-dihydropyrazolo[4,3-b]pyridine is Cn1cc2c(n1)C=C(C(F)(F)F)CN2.
What is the InChIKey of 2-methyl-6-(trifluoromethyl)-4,5-dihydropyrazolo[4,3-b]pyridine?
The InChIKey is PQPFLUGLKXRVPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F3N3/c1-14-4-7-6(13-14)2-5(3-12-7)8(9,10)11/h2,4,12H,3H2,1H3.
What are the key properties of 2-methyl-6-(trifluoromethyl)-4,5-dihydropyrazolo[4,3-b]pyridine?
2-methyl-6-(trifluoromethyl)-4,5-dihydropyrazolo[4,3-b]pyridine has a molecular weight of 203.17 g/mol, XLogP of 1.79, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(trifluoromethyl)-4,5-dihydropyrazolo[4,3-b]pyridine is sourced from PubChem (CID 142401143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).