4-amino-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazole-3-carboxylic acid

C10H7F3N4O2 — CID 107345897

IUPAC4-amino-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazole-3-carboxylic acid
SMILESNc1cn(-c2ccc(C(F)(F)F)cn2)nc1C(=O)O
InChIInChI=1S/C10H7F3N4O2/c11-10(12,13)5-1-2-7(15-3-5)17-4-6(14)8(16-17)9(18)19/h1-4H,14H2,(H,18,19)
InChIKeyGZNGWWXBASJZTM-UHFFFAOYSA-N
MW272.19 g/mol
LogP1.57
Rot. Bonds2

About 4-amino-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazole-3-carboxylic acid

4-amino-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazole-3-carboxylic acid (PubChem CID 107345897) has the molecular formula C10H7F3N4O2 and a molecular weight of 272.19 g/mol. Its IUPAC name is 4-amino-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazole-3-carboxylic acid.

Molecular Properties

Compound Name4-amino-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazole-3-carboxylic acid
PubChem CID107345897
Molecular FormulaC10H7F3N4O2
Molecular Weight272.19 g/mol
Exact Mass272.05
IUPAC Name4-amino-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazole-3-carboxylic acid
SMILESNc1cn(-c2ccc(C(F)(F)F)cn2)nc1C(=O)O
InChIInChI=1S/C10H7F3N4O2/c11-10(12,13)5-1-2-7(15-3-5)17-4-6(14)8(16-17)9(18)19/h1-4H,14H2,(H,18,19)
InChIKeyGZNGWWXBASJZTM-UHFFFAOYSA-N
XLogP1.57
TPSA94.03 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.19
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-amino-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazole-3-carboxylic acid 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

3-cyclopentyl-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazol-4-amine
CID 83205345
1-[5-(trifluoromethyl)-2-pyridinyl]pyrazol-3-amine;hydrochloride
CID 90484283
4-amino-1-[6-(trifluoromethyl)pyridazin-3-yl]pyrazole-3-carboxamide
CID 107346541
4-amino-1-pyrimidin-2-ylpyrazole-3-carboxylic acid
CID 107346027
4-amino-1-(5-cyano-2-pyridinyl)pyrazole-3-carboxamide
CID 107346504
methyl 4-amino-1-[4-(trifluoromethyl)phenyl]pyrazole-3-carboxylate
CID 107346344
2-(3-methyl-1,2,4-triazol-1-yl)-5-(trifluoromethyl)pyridine
CID 134947582
2-ethyl-4-[1-[5-(trifluoromethyl)-2-pyridinyl]pyrazol-3-yl]aniline
CID 155580523
[5-amino-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazol-4-yl] hydrogen carbonate
CID 70427619
6-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridin-3-amine
CID 2741603
5-oxo-1-[5-(trifluoromethyl)-2-pyridinyl]-4H-pyrazole-3-carboxylic acid
CID 61389260
(E)-3-[3-propan-2-yl-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazol-4-yl]prop-2-enoate
CID 154228960

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazole-3-carboxylic acid?
The IUPAC name of 4-amino-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazole-3-carboxylic acid (CID 107345897) is 4-amino-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazole-3-carboxylic acid.
What is the SMILES notation for 4-amino-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazole-3-carboxylic acid?
The canonical SMILES for 4-amino-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazole-3-carboxylic acid is Nc1cn(-c2ccc(C(F)(F)F)cn2)nc1C(=O)O.
What is the InChIKey of 4-amino-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazole-3-carboxylic acid?
The InChIKey is GZNGWWXBASJZTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7F3N4O2/c11-10(12,13)5-1-2-7(15-3-5)17-4-6(14)8(16-17)9(18)19/h1-4H,14H2,(H,18,19).
What are the key properties of 4-amino-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazole-3-carboxylic acid?
4-amino-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazole-3-carboxylic acid has a molecular weight of 272.19 g/mol, XLogP of 1.57, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazole-3-carboxylic acid is sourced from PubChem (CID 107345897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).