N-(3,5-difluorophenyl)-1,5-dimethylpyrazole-3-carboxamide

C12H11F2N3O — CID 163344155

IUPACN-(3,5-difluorophenyl)-1,5-dimethylpyrazole-3-carboxamide
SMILESCc1cc(C(=O)Nc2cc(F)cc(F)c2)nn1C
InChIInChI=1S/C12H11F2N3O/c1-7-3-11(16-17(7)2)12(18)15-10-5-8(13)4-9(14)6-10/h3-6H,1-2H3,(H,15,18)
InChIKeySPJOVGYWRWINEZ-UHFFFAOYSA-N
MW251.24 g/mol
LogP2.26
Rot. Bonds2

About N-(3,5-difluorophenyl)-1,5-dimethylpyrazole-3-carboxamide

N-(3,5-difluorophenyl)-1,5-dimethylpyrazole-3-carboxamide (PubChem CID 163344155) has the molecular formula C12H11F2N3O and a molecular weight of 251.24 g/mol. Its IUPAC name is N-(3,5-difluorophenyl)-1,5-dimethylpyrazole-3-carboxamide.

Molecular Properties

Compound NameN-(3,5-difluorophenyl)-1,5-dimethylpyrazole-3-carboxamide
PubChem CID163344155
Molecular FormulaC12H11F2N3O
Molecular Weight251.24 g/mol
Exact Mass251.09
IUPAC NameN-(3,5-difluorophenyl)-1,5-dimethylpyrazole-3-carboxamide
SMILESCc1cc(C(=O)Nc2cc(F)cc(F)c2)nn1C
InChIInChI=1S/C12H11F2N3O/c1-7-3-11(16-17(7)2)12(18)15-10-5-8(13)4-9(14)6-10/h3-6H,1-2H3,(H,15,18)
InChIKeySPJOVGYWRWINEZ-UHFFFAOYSA-N
XLogP2.26
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.24
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(3,5-difluorophenyl)-1,5-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

4-[(1,5-dimethylpyrazole-3-carbonyl)amino]benzoic acid
CID 113263077
N-[4-(dimethylamino)phenyl]-1,5-dimethylpyrazole-3-carboxamide
CID 110685819
N-(3-hydroxy-4-methylphenyl)-1,5-dimethylpyrazole-3-carboxamide
CID 113290195
N-(4-bromo-3-methylphenyl)-1,5-dimethylpyrazole-3-carboxamide
CID 110685830
N-carbamoyl-1,5-dimethylpyrazole-3-carboxamide
CID 130485672
N-(4,6-difluoro-1,3-benzothiazol-2-yl)-1,5-dimethylpyrazole-3-carboxamide
CID 16809678
3-N,5-N-bis(3-fluorophenyl)-1-methylpyrazole-3,5-dicarboxamide
CID 29097363
1,5-dimethyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide
CID 167906110
N-(3-methoxyphenyl)-1,5-dimethylpyrazole-3-carboxamide
CID 19279593
N-[3-(ethylaminomethyl)phenyl]-1,5-dimethylpyrazole-3-carboxamide
CID 119438262
1,5-dimethyl-N-(2-propan-2-ylphenyl)pyrazole-3-carboxamide
CID 110685790
N-(3-fluorophenyl)-1-methyl-5-(2,4,6-trimethylphenyl)pyrazole-3-carboxamide
CID 46104761

Frequently Asked Questions

What is the IUPAC name of N-(3,5-difluorophenyl)-1,5-dimethylpyrazole-3-carboxamide?
The IUPAC name of N-(3,5-difluorophenyl)-1,5-dimethylpyrazole-3-carboxamide (CID 163344155) is N-(3,5-difluorophenyl)-1,5-dimethylpyrazole-3-carboxamide.
What is the SMILES notation for N-(3,5-difluorophenyl)-1,5-dimethylpyrazole-3-carboxamide?
The canonical SMILES for N-(3,5-difluorophenyl)-1,5-dimethylpyrazole-3-carboxamide is Cc1cc(C(=O)Nc2cc(F)cc(F)c2)nn1C.
What is the InChIKey of N-(3,5-difluorophenyl)-1,5-dimethylpyrazole-3-carboxamide?
The InChIKey is SPJOVGYWRWINEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11F2N3O/c1-7-3-11(16-17(7)2)12(18)15-10-5-8(13)4-9(14)6-10/h3-6H,1-2H3,(H,15,18).
What are the key properties of N-(3,5-difluorophenyl)-1,5-dimethylpyrazole-3-carboxamide?
N-(3,5-difluorophenyl)-1,5-dimethylpyrazole-3-carboxamide has a molecular weight of 251.24 g/mol, XLogP of 2.26, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-difluorophenyl)-1,5-dimethylpyrazole-3-carboxamide is sourced from PubChem (CID 163344155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).