N-(6-fluoro-3-pyridinyl)-2,5-dimethylpyrazole-3-carboxamide

C11H11FN4O — CID 103789986

IUPACN-(6-fluoro-3-pyridinyl)-2,5-dimethylpyrazole-3-carboxamide
SMILESCc1cc(C(=O)Nc2ccc(F)nc2)n(C)n1
InChIInChI=1S/C11H11FN4O/c1-7-5-9(16(2)15-7)11(17)14-8-3-4-10(12)13-6-8/h3-6H,1-2H3,(H,14,17)
InChIKeyZHRDCKNBQOPNIC-UHFFFAOYSA-N
MW234.23 g/mol
LogP1.51
Rot. Bonds2

About N-(6-fluoro-3-pyridinyl)-2,5-dimethylpyrazole-3-carboxamide

N-(6-fluoro-3-pyridinyl)-2,5-dimethylpyrazole-3-carboxamide (PubChem CID 103789986) has the molecular formula C11H11FN4O and a molecular weight of 234.23 g/mol. Its IUPAC name is N-(6-fluoro-3-pyridinyl)-2,5-dimethylpyrazole-3-carboxamide.

Molecular Properties

Compound NameN-(6-fluoro-3-pyridinyl)-2,5-dimethylpyrazole-3-carboxamide
PubChem CID103789986
Molecular FormulaC11H11FN4O
Molecular Weight234.23 g/mol
Exact Mass234.09
IUPAC NameN-(6-fluoro-3-pyridinyl)-2,5-dimethylpyrazole-3-carboxamide
SMILESCc1cc(C(=O)Nc2ccc(F)nc2)n(C)n1
InChIInChI=1S/C11H11FN4O/c1-7-5-9(16(2)15-7)11(17)14-8-3-4-10(12)13-6-8/h3-6H,1-2H3,(H,14,17)
InChIKeyZHRDCKNBQOPNIC-UHFFFAOYSA-N
XLogP1.51
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.23
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze N-(6-fluoro-3-pyridinyl)-2,5-dimethylpyrazole-3-carboxamide 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

N-(3,4-dimethylphenyl)-2,5-dimethylpyrazole-3-carboxamide
CID 110685886
4-[(2,5-dimethylpyrazole-3-carbonyl)amino]-2-fluorobenzoic acid
CID 103791549
N-(4-tert-butylphenyl)-2,5-dimethylpyrazole-3-carboxamide
CID 110685894
N-(6-fluoro-3-pyridinyl)-1,3-dimethylpyrazole-4-carboxamide
CID 103789989
4-[(2,5-dimethylpyrazole-3-carbonyl)amino]benzenesulfonyl chloride
CID 66128613
N-[4-(bromomethyl)phenyl]-2,5-dimethylpyrazole-3-carboxamide
CID 114310907
N-(2,4-difluorophenyl)-2,5-dimethylpyrazole-3-carboxamide
CID 110685919
2,5-dimethyl-N-[4-(trifluoromethoxy)phenyl]pyrazole-3-carboxamide
CID 19481229
4-[(2,5-dimethylpyrazole-3-carbonyl)amino]-2-fluorobenzenesulfonyl chloride
CID 66128821
N-[4-(difluoromethoxy)-3-fluorophenyl]-2,5-dimethylpyrazole-3-carboxamide
CID 87026065
N-(3-methoxyphenyl)-2,5-dimethylpyrazole-3-carboxamide
CID 19481236
N-(3-acetylphenyl)-2,5-dimethylpyrazole-3-carboxamide
CID 61059268

Frequently Asked Questions

What is the IUPAC name of N-(6-fluoro-3-pyridinyl)-2,5-dimethylpyrazole-3-carboxamide?
The IUPAC name of N-(6-fluoro-3-pyridinyl)-2,5-dimethylpyrazole-3-carboxamide (CID 103789986) is N-(6-fluoro-3-pyridinyl)-2,5-dimethylpyrazole-3-carboxamide.
What is the SMILES notation for N-(6-fluoro-3-pyridinyl)-2,5-dimethylpyrazole-3-carboxamide?
The canonical SMILES for N-(6-fluoro-3-pyridinyl)-2,5-dimethylpyrazole-3-carboxamide is Cc1cc(C(=O)Nc2ccc(F)nc2)n(C)n1.
What is the InChIKey of N-(6-fluoro-3-pyridinyl)-2,5-dimethylpyrazole-3-carboxamide?
The InChIKey is ZHRDCKNBQOPNIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN4O/c1-7-5-9(16(2)15-7)11(17)14-8-3-4-10(12)13-6-8/h3-6H,1-2H3,(H,14,17).
What are the key properties of N-(6-fluoro-3-pyridinyl)-2,5-dimethylpyrazole-3-carboxamide?
N-(6-fluoro-3-pyridinyl)-2,5-dimethylpyrazole-3-carboxamide has a molecular weight of 234.23 g/mol, XLogP of 1.51, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-fluoro-3-pyridinyl)-2,5-dimethylpyrazole-3-carboxamide is sourced from PubChem (CID 103789986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).