3-cyclopropyl-1-methyl-4-(trifluoromethyl)-7H-pyrazolo[5,4-b]pyridin-6-one

C11H10F3N3O — CID 135768552

IUPAC3-cyclopropyl-1-methyl-4-(trifluoromethyl)-7H-pyrazolo[5,4-b]pyridin-6-one
SMILESCn1nc(C2CC2)c2c(C(F)(F)F)cc(=O)[nH]c21
InChIInChI=1S/C11H10F3N3O/c1-17-10-8(9(16-17)5-2-3-5)6(11(12,13)14)4-7(18)15-10/h4-5H,2-3H2,1H3,(H,15,18)
InChIKeyICXALJOMHJHQRP-UHFFFAOYSA-N
MW257.21 g/mol
LogP2.16
Rot. Bonds1

About 3-cyclopropyl-1-methyl-4-(trifluoromethyl)-7H-pyrazolo[5,4-b]pyridin-6-one

3-cyclopropyl-1-methyl-4-(trifluoromethyl)-7H-pyrazolo[5,4-b]pyridin-6-one (PubChem CID 135768552) has the molecular formula C11H10F3N3O and a molecular weight of 257.21 g/mol. Its IUPAC name is 3-cyclopropyl-1-methyl-4-(trifluoromethyl)-7H-pyrazolo[5,4-b]pyridin-6-one.

Molecular Properties

Compound Name3-cyclopropyl-1-methyl-4-(trifluoromethyl)-7H-pyrazolo[5,4-b]pyridin-6-one
PubChem CID135768552
Molecular FormulaC11H10F3N3O
Molecular Weight257.21 g/mol
Exact Mass257.08
IUPAC Name3-cyclopropyl-1-methyl-4-(trifluoromethyl)-7H-pyrazolo[5,4-b]pyridin-6-one
SMILESCn1nc(C2CC2)c2c(C(F)(F)F)cc(=O)[nH]c21
InChIInChI=1S/C11H10F3N3O/c1-17-10-8(9(16-17)5-2-3-5)6(11(12,13)14)4-7(18)15-10/h4-5H,2-3H2,1H3,(H,15,18)
InChIKeyICXALJOMHJHQRP-UHFFFAOYSA-N
XLogP2.16
TPSA50.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.21
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-cyclopropyl-1-methyl-4-(trifluoromethyl)-7H-pyrazolo[5,4-b]pyridin-6-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,3-Dimethyl-3,4,6,7,8,9-hexahydropyrazolo[3,4-c]isoquinolin-5-one
CID 135512456
3,5-Dimethyl-4,5,7-triazatricyclo[7.3.0.0^{2,6}]dodeca-1(9),2(6),3-trien-8-one
CID 135621700
1,3,4-trimethyl-1H,6H,7H-pyrazolo(3,4-b)pyridin-6-one
CID 135447117
3-[3-methyl-6-oxo-4-(trifluoromethyl)-7H-pyrazolo[5,4-b]pyridin-1-yl]propanenitrile
CID 135495515
1-(tert-butyl)-3,4-dimethyl-1H-pyrazolo[3,4-b]pyridin-6-ol
CID 135418903
1-cyclopentyl-3,4-dimethyl-1,7-dihydro-6H-pyrazolo[3,4-b]pyridin-6-one
CID 135413839
N-tert-butyl-2-[1,3-dimethyl-6-oxo-4-(trifluoromethyl)pyrazolo[5,4-b]pyridin-7-yl]acetamide
CID 16026409
3,4-dimethyl-1-pentyl-1H-pyrazolo[3,4-b]pyridin-6-ol
CID 135406013
1-Cyclohexyl-3,4-dimethyl-1,7-dihydro-pyrazolo[3,4-b]pyridin-6-one
CID 135473418
1,3-dimethyl-4-(pentafluoroethyl)-1,7-dihydro-6H-pyrazolo[3,4-b]pyridin-6-one
CID 135645637
2-[1,3-dimethyl-6-oxo-4-(trifluoromethyl)pyrazolo[5,4-b]pyridin-7-yl]-N-(3-methylbutyl)acetamide
CID 16026439
1-ethyl-3-methyl-4-(pentafluoroethyl)-1,7-dihydro-6H-pyrazolo[3,4-b]pyridin-6-one
CID 135636186

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-1-methyl-4-(trifluoromethyl)-7H-pyrazolo[5,4-b]pyridin-6-one?
The IUPAC name of 3-cyclopropyl-1-methyl-4-(trifluoromethyl)-7H-pyrazolo[5,4-b]pyridin-6-one (CID 135768552) is 3-cyclopropyl-1-methyl-4-(trifluoromethyl)-7H-pyrazolo[5,4-b]pyridin-6-one.
What is the SMILES notation for 3-cyclopropyl-1-methyl-4-(trifluoromethyl)-7H-pyrazolo[5,4-b]pyridin-6-one?
The canonical SMILES for 3-cyclopropyl-1-methyl-4-(trifluoromethyl)-7H-pyrazolo[5,4-b]pyridin-6-one is Cn1nc(C2CC2)c2c(C(F)(F)F)cc(=O)[nH]c21.
What is the InChIKey of 3-cyclopropyl-1-methyl-4-(trifluoromethyl)-7H-pyrazolo[5,4-b]pyridin-6-one?
The InChIKey is ICXALJOMHJHQRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F3N3O/c1-17-10-8(9(16-17)5-2-3-5)6(11(12,13)14)4-7(18)15-10/h4-5H,2-3H2,1H3,(H,15,18).
What are the key properties of 3-cyclopropyl-1-methyl-4-(trifluoromethyl)-7H-pyrazolo[5,4-b]pyridin-6-one?
3-cyclopropyl-1-methyl-4-(trifluoromethyl)-7H-pyrazolo[5,4-b]pyridin-6-one has a molecular weight of 257.21 g/mol, XLogP of 2.16, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-1-methyl-4-(trifluoromethyl)-7H-pyrazolo[5,4-b]pyridin-6-one is sourced from PubChem (CID 135768552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).