6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1H-pyrazolo[4,3-c]pyridine

C11H8F3N5 — CID 86707162

IUPAC6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1H-pyrazolo[4,3-c]pyridine
SMILESFC(F)(F)Cn1cc(-c2cc3[nH]ncc3cn2)cn1
InChIInChI=1S/C11H8F3N5/c12-11(13,14)6-19-5-8(4-17-19)9-1-10-7(2-15-9)3-16-18-10/h1-5H,6H2,(H,16,18)
InChIKeyRPAUVEOJMLQJCB-UHFFFAOYSA-N
MW267.21 g/mol
LogP2.38
Rot. Bonds2

About 6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1H-pyrazolo[4,3-c]pyridine

6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1H-pyrazolo[4,3-c]pyridine (PubChem CID 86707162) has the molecular formula C11H8F3N5 and a molecular weight of 267.21 g/mol. Its IUPAC name is 6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1H-pyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1H-pyrazolo[4,3-c]pyridine
PubChem CID86707162
Molecular FormulaC11H8F3N5
Molecular Weight267.21 g/mol
Exact Mass267.07
IUPAC Name6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1H-pyrazolo[4,3-c]pyridine
SMILESFC(F)(F)Cn1cc(-c2cc3[nH]ncc3cn2)cn1
InChIInChI=1S/C11H8F3N5/c12-11(13,14)6-19-5-8(4-17-19)9-1-10-7(2-15-9)3-16-18-10/h1-5H,6H2,(H,16,18)
InChIKeyRPAUVEOJMLQJCB-UHFFFAOYSA-N
XLogP2.38
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.21
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1H-pyrazolo[4,3-c]pyridine?
The IUPAC name of 6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1H-pyrazolo[4,3-c]pyridine (CID 86707162) is 6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1H-pyrazolo[4,3-c]pyridine.
What is the SMILES notation for 6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1H-pyrazolo[4,3-c]pyridine?
The canonical SMILES for 6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1H-pyrazolo[4,3-c]pyridine is FC(F)(F)Cn1cc(-c2cc3[nH]ncc3cn2)cn1.
What is the InChIKey of 6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1H-pyrazolo[4,3-c]pyridine?
The InChIKey is RPAUVEOJMLQJCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8F3N5/c12-11(13,14)6-19-5-8(4-17-19)9-1-10-7(2-15-9)3-16-18-10/h1-5H,6H2,(H,16,18).
What are the key properties of 6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1H-pyrazolo[4,3-c]pyridine?
6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1H-pyrazolo[4,3-c]pyridine has a molecular weight of 267.21 g/mol, XLogP of 2.38, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1H-pyrazolo[4,3-c]pyridine is sourced from PubChem (CID 86707162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).