N-(2,5-dimethylpyrazol-3-yl)-1-(4-fluoro-2-methylphenyl)-4-hydroxypyrazole-3-carboxamide

C16H16FN5O2 — CID 71975746

IUPACN-(2,5-dimethylpyrazol-3-yl)-1-(4-fluoro-2-methylphenyl)-4-hydroxypyrazole-3-carboxamide
SMILESCc1cc(NC(=O)c2nn(-c3ccc(F)cc3C)cc2O)n(C)n1
InChIInChI=1S/C16H16FN5O2/c1-9-6-11(17)4-5-12(9)22-8-13(23)15(20-22)16(24)18-14-7-10(2)19-21(14)3/h4-8,23H,1-3H3,(H,18,24)
InChIKeyOSBSICNGKOJVEA-UHFFFAOYSA-N
MW329.34 g/mol
LogP2.32
Rot. Bonds3

About N-(2,5-dimethylpyrazol-3-yl)-1-(4-fluoro-2-methylphenyl)-4-hydroxypyrazole-3-carboxamide

N-(2,5-dimethylpyrazol-3-yl)-1-(4-fluoro-2-methylphenyl)-4-hydroxypyrazole-3-carboxamide (PubChem CID 71975746) has the molecular formula C16H16FN5O2 and a molecular weight of 329.34 g/mol. Its IUPAC name is N-(2,5-dimethylpyrazol-3-yl)-1-(4-fluoro-2-methylphenyl)-4-hydroxypyrazole-3-carboxamide.

Molecular Properties

Compound NameN-(2,5-dimethylpyrazol-3-yl)-1-(4-fluoro-2-methylphenyl)-4-hydroxypyrazole-3-carboxamide
PubChem CID71975746
Molecular FormulaC16H16FN5O2
Molecular Weight329.34 g/mol
Exact Mass329.13
IUPAC NameN-(2,5-dimethylpyrazol-3-yl)-1-(4-fluoro-2-methylphenyl)-4-hydroxypyrazole-3-carboxamide
SMILESCc1cc(NC(=O)c2nn(-c3ccc(F)cc3C)cc2O)n(C)n1
InChIInChI=1S/C16H16FN5O2/c1-9-6-11(17)4-5-12(9)22-8-13(23)15(20-22)16(24)18-14-7-10(2)19-21(14)3/h4-8,23H,1-3H3,(H,18,24)
InChIKeyOSBSICNGKOJVEA-UHFFFAOYSA-N
XLogP2.32
TPSA84.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.34
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-(2,5-dimethylpyrazol-3-yl)-1-(4-fluoro-2-methylphenyl)-4-hydroxypyrazole-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-(2-amino-2-ethylbutyl)-1-(4-fluoro-2-methylphenyl)-4-hydroxypyrazole-3-carboxamide
CID 119642881
N-(3-aminobutyl)-1-(4-fluoro-2-methylphenyl)-4-hydroxypyrazole-3-carboxamide
CID 119498479
N-(3-amino-2-methylpropyl)-1-(4-fluoro-2-methylphenyl)-4-hydroxypyrazole-3-carboxamide
CID 119996780
1-(4-fluoro-2-methylphenyl)-4-hydroxy-N-[(1-hydroxycyclopentyl)methyl]pyrazole-3-carboxamide
CID 111911950
5-[[1-(4-fluoro-2-methylphenyl)-4-hydroxypyrazole-3-carbonyl]amino]-1H-indazole-3-carboxylic acid
CID 167802563
N-(1-aminohexan-2-yl)-1-(4-fluoro-2-methylphenyl)-4-hydroxypyrazole-3-carboxamide;hydrochloride
CID 119667812
N-[(1R)-1-[4-(cyclopropanecarbonylamino)phenyl]ethyl]-1-(4-fluoro-2-methylphenyl)-4-hydroxypyrazole-3-carboxamide
CID 96533724
1-(4-fluoro-2-methylphenyl)-4-hydroxy-N-(piperidin-3-ylmethyl)pyrazole-3-carboxamide;hydrochloride
CID 119463429
[1-(4-fluoro-2-methylphenyl)-4-hydroxypyrazol-3-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone
CID 111912334
2-[[[1-(4-fluoro-2-methylphenyl)-4-hydroxypyrazole-3-carbonyl]amino]methyl]morpholine-4-carboxamide
CID 166244486
1-(4-fluoro-2-methylphenyl)-4-hydroxy-N-[(2R)-3-hydroxy-2-[(3R)-oxolan-3-yl]propyl]pyrazole-3-carboxamide
CID 100644712
[1-(4-fluoro-2-methylphenyl)-4-hydroxypyrazol-3-yl]-[3-(methylamino)piperidin-1-yl]methanone;hydrochloride
CID 119492285

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethylpyrazol-3-yl)-1-(4-fluoro-2-methylphenyl)-4-hydroxypyrazole-3-carboxamide?
The IUPAC name of N-(2,5-dimethylpyrazol-3-yl)-1-(4-fluoro-2-methylphenyl)-4-hydroxypyrazole-3-carboxamide (CID 71975746) is N-(2,5-dimethylpyrazol-3-yl)-1-(4-fluoro-2-methylphenyl)-4-hydroxypyrazole-3-carboxamide.
What is the SMILES notation for N-(2,5-dimethylpyrazol-3-yl)-1-(4-fluoro-2-methylphenyl)-4-hydroxypyrazole-3-carboxamide?
The canonical SMILES for N-(2,5-dimethylpyrazol-3-yl)-1-(4-fluoro-2-methylphenyl)-4-hydroxypyrazole-3-carboxamide is Cc1cc(NC(=O)c2nn(-c3ccc(F)cc3C)cc2O)n(C)n1.
What is the InChIKey of N-(2,5-dimethylpyrazol-3-yl)-1-(4-fluoro-2-methylphenyl)-4-hydroxypyrazole-3-carboxamide?
The InChIKey is OSBSICNGKOJVEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FN5O2/c1-9-6-11(17)4-5-12(9)22-8-13(23)15(20-22)16(24)18-14-7-10(2)19-21(14)3/h4-8,23H,1-3H3,(H,18,24).
What are the key properties of N-(2,5-dimethylpyrazol-3-yl)-1-(4-fluoro-2-methylphenyl)-4-hydroxypyrazole-3-carboxamide?
N-(2,5-dimethylpyrazol-3-yl)-1-(4-fluoro-2-methylphenyl)-4-hydroxypyrazole-3-carboxamide has a molecular weight of 329.34 g/mol, XLogP of 2.32, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethylpyrazol-3-yl)-1-(4-fluoro-2-methylphenyl)-4-hydroxypyrazole-3-carboxamide is sourced from PubChem (CID 71975746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).