2-(fluoromethyl)-5-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol

C11H17FN2O — CID 129296359

IUPAC2-(fluoromethyl)-5-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol
SMILESCC(C)C1CCn2nc(CF)cc2C1O
InChIInChI=1S/C11H17FN2O/c1-7(2)9-3-4-14-10(11(9)15)5-8(6-12)13-14/h5,7,9,11,15H,3-4,6H2,1-2H3
InChIKeyXRQGADVHHUETPI-UHFFFAOYSA-N
MW212.27 g/mol
LogP2.06
Rot. Bonds2

About 2-(fluoromethyl)-5-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol

2-(fluoromethyl)-5-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol (PubChem CID 129296359) has the molecular formula C11H17FN2O and a molecular weight of 212.27 g/mol. Its IUPAC name is 2-(fluoromethyl)-5-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol.

Molecular Properties

Compound Name2-(fluoromethyl)-5-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol
PubChem CID129296359
Molecular FormulaC11H17FN2O
Molecular Weight212.27 g/mol
Exact Mass212.13
IUPAC Name2-(fluoromethyl)-5-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol
SMILESCC(C)C1CCn2nc(CF)cc2C1O
InChIInChI=1S/C11H17FN2O/c1-7(2)9-3-4-14-10(11(9)15)5-8(6-12)13-14/h5,7,9,11,15H,3-4,6H2,1-2H3
InChIKeyXRQGADVHHUETPI-UHFFFAOYSA-N
XLogP2.06
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.27
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(fluoromethyl)-5-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol?
The IUPAC name of 2-(fluoromethyl)-5-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol (CID 129296359) is 2-(fluoromethyl)-5-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol.
What is the SMILES notation for 2-(fluoromethyl)-5-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol?
The canonical SMILES for 2-(fluoromethyl)-5-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol is CC(C)C1CCn2nc(CF)cc2C1O.
What is the InChIKey of 2-(fluoromethyl)-5-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol?
The InChIKey is XRQGADVHHUETPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17FN2O/c1-7(2)9-3-4-14-10(11(9)15)5-8(6-12)13-14/h5,7,9,11,15H,3-4,6H2,1-2H3.
What are the key properties of 2-(fluoromethyl)-5-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol?
2-(fluoromethyl)-5-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol has a molecular weight of 212.27 g/mol, XLogP of 2.06, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(fluoromethyl)-5-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol is sourced from PubChem (CID 129296359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).