(2,5-dimethylpyrazol-3-yl)-[3-hydroxy-5-methyl-3-(trifluoromethyl)-1H-pyrazol-2-yl]methanone

C11H13F3N4O2 — CID 4744910

IUPAC(2,5-dimethylpyrazol-3-yl)-[3-hydroxy-5-methyl-3-(trifluoromethyl)-1H-pyrazol-2-yl]methanone
SMILESCC1=CC(O)(C(F)(F)F)N(C(=O)c2cc(C)nn2C)N1
InChIInChI=1S/C11H13F3N4O2/c1-6-4-8(17(3)15-6)9(19)18-10(20,11(12,13)14)5-7(2)16-18/h4-5,16,20H,1-3H3
InChIKeyHYDSZGQKCGEMRN-UHFFFAOYSA-N
MW290.25 g/mol
LogP0.84
Rot. Bonds1

About (2,5-dimethylpyrazol-3-yl)-[3-hydroxy-5-methyl-3-(trifluoromethyl)-1H-pyrazol-2-yl]methanone

(2,5-dimethylpyrazol-3-yl)-[3-hydroxy-5-methyl-3-(trifluoromethyl)-1H-pyrazol-2-yl]methanone (PubChem CID 4744910) has the molecular formula C11H13F3N4O2 and a molecular weight of 290.25 g/mol. Its IUPAC name is (2,5-dimethylpyrazol-3-yl)-[3-hydroxy-5-methyl-3-(trifluoromethyl)-1H-pyrazol-2-yl]methanone.

Molecular Properties

Compound Name(2,5-dimethylpyrazol-3-yl)-[3-hydroxy-5-methyl-3-(trifluoromethyl)-1H-pyrazol-2-yl]methanone
PubChem CID4744910
Molecular FormulaC11H13F3N4O2
Molecular Weight290.25 g/mol
Exact Mass290.10
IUPAC Name(2,5-dimethylpyrazol-3-yl)-[3-hydroxy-5-methyl-3-(trifluoromethyl)-1H-pyrazol-2-yl]methanone
SMILESCC1=CC(O)(C(F)(F)F)N(C(=O)c2cc(C)nn2C)N1
InChIInChI=1S/C11H13F3N4O2/c1-6-4-8(17(3)15-6)9(19)18-10(20,11(12,13)14)5-7(2)16-18/h4-5,16,20H,1-3H3
InChIKeyHYDSZGQKCGEMRN-UHFFFAOYSA-N
XLogP0.84
TPSA70.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.25
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (2,5-dimethylpyrazol-3-yl)-[3-hydroxy-5-methyl-3-(trifluoromethyl)-1H-pyrazol-2-yl]methanone 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-[(1,3-dimethyl-1H-pyrazol-5-yl)carbonyl]-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol
CID 3453921
[3,5-bis(difluoromethyl)-5-hydroxy-4H-pyrazol-1-yl]-(2,5-dimethylpyrazol-3-yl)methanone
CID 5140192
1,5-dimethyl-1H-pyrazole-3-carbohydrazide
CID 2743273
2-[(8S)-4-oxo-2-(trifluoromethyl)-4,5-dihydropyrazolo[1,5-a]pyrazin-6-yl]acetamide
CID 162540442
1-Ethyl-3-methyl-1h-pyrazole-5-carbohydrazide
CID 2744172
N-cyclopentyl-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
CID 1236040
1-(difluoromethyl)-5-methyl-N-[3-(2-oxopyrrolidin-1-yl)propyl]-1H-pyrazole-3-carboxamide
CID 19586730
N,1,5-trimethyl-N-[2-[(2,2,2-trifluoroacetyl)amino]ethyl]pyrazole-3-carboxamide
CID 44757297
N-[(2S)-2-(3,5-dimethylpyrazol-1-yl)propyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide
CID 97899787
5-(difluoromethyl)-1-methyl-N-[(3S)-5-oxo-1-propan-2-ylpyrrolidin-3-yl]pyrazole-3-carboxamide
CID 164632429
[3,5-bis(difluoromethyl)-5-hydroxy-4H-pyrazol-1-yl]-(1,5-dimethylpyrazol-3-yl)methanone
CID 3472762
(1,5-dimethyl-1H-pyrazol-3-yl)[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]methanone
CID 4765803

Frequently Asked Questions

What is the IUPAC name of (2,5-dimethylpyrazol-3-yl)-[3-hydroxy-5-methyl-3-(trifluoromethyl)-1H-pyrazol-2-yl]methanone?
The IUPAC name of (2,5-dimethylpyrazol-3-yl)-[3-hydroxy-5-methyl-3-(trifluoromethyl)-1H-pyrazol-2-yl]methanone (CID 4744910) is (2,5-dimethylpyrazol-3-yl)-[3-hydroxy-5-methyl-3-(trifluoromethyl)-1H-pyrazol-2-yl]methanone.
What is the SMILES notation for (2,5-dimethylpyrazol-3-yl)-[3-hydroxy-5-methyl-3-(trifluoromethyl)-1H-pyrazol-2-yl]methanone?
The canonical SMILES for (2,5-dimethylpyrazol-3-yl)-[3-hydroxy-5-methyl-3-(trifluoromethyl)-1H-pyrazol-2-yl]methanone is CC1=CC(O)(C(F)(F)F)N(C(=O)c2cc(C)nn2C)N1.
What is the InChIKey of (2,5-dimethylpyrazol-3-yl)-[3-hydroxy-5-methyl-3-(trifluoromethyl)-1H-pyrazol-2-yl]methanone?
The InChIKey is HYDSZGQKCGEMRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F3N4O2/c1-6-4-8(17(3)15-6)9(19)18-10(20,11(12,13)14)5-7(2)16-18/h4-5,16,20H,1-3H3.
What are the key properties of (2,5-dimethylpyrazol-3-yl)-[3-hydroxy-5-methyl-3-(trifluoromethyl)-1H-pyrazol-2-yl]methanone?
(2,5-dimethylpyrazol-3-yl)-[3-hydroxy-5-methyl-3-(trifluoromethyl)-1H-pyrazol-2-yl]methanone has a molecular weight of 290.25 g/mol, XLogP of 0.84, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dimethylpyrazol-3-yl)-[3-hydroxy-5-methyl-3-(trifluoromethyl)-1H-pyrazol-2-yl]methanone is sourced from PubChem (CID 4744910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).