6-(dimethylsulfamoyl)-N-[2-methyl-5-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide

C25H22F3N5O4S — CID 16662084

IUPAC6-(dimethylsulfamoyl)-N-[2-methyl-5-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)c1cnn2cc(S(=O)(=O)N(C)C)ccc12
InChIInChI=1S/C25H22F3N5O4S/c1-15-7-8-16(23(34)30-18-6-4-5-17(12-18)25(26,27)28)11-21(15)31-24(35)20-13-29-33-14-19(9-10-22(20)33)38(36,37)32(2)3/h4-14H,1-3H3,(H,30,34)(H,31,35)
InChIKeyFNLOOMKOQOZFEH-UHFFFAOYSA-N
MW545.54 g/mol
LogP4.42
Rot. Bonds6

About 6-(dimethylsulfamoyl)-N-[2-methyl-5-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide

6-(dimethylsulfamoyl)-N-[2-methyl-5-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 16662084) has the molecular formula C25H22F3N5O4S and a molecular weight of 545.54 g/mol. Its IUPAC name is 6-(dimethylsulfamoyl)-N-[2-methyl-5-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(dimethylsulfamoyl)-N-[2-methyl-5-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide
PubChem CID16662084
Molecular FormulaC25H22F3N5O4S
Molecular Weight545.54 g/mol
Exact Mass545.13
IUPAC Name6-(dimethylsulfamoyl)-N-[2-methyl-5-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)c1cnn2cc(S(=O)(=O)N(C)C)ccc12
InChIInChI=1S/C25H22F3N5O4S/c1-15-7-8-16(23(34)30-18-6-4-5-17(12-18)25(26,27)28)11-21(15)31-24(35)20-13-29-33-14-19(9-10-22(20)33)38(36,37)32(2)3/h4-14H,1-3H3,(H,30,34)(H,31,35)
InChIKeyFNLOOMKOQOZFEH-UHFFFAOYSA-N
XLogP4.42
TPSA112.88 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500545.54
LogP ≤ 54.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 6-(dimethylsulfamoyl)-N-[2-methyl-5-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide with MolForge

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Related Compounds

1-(4-Fluoro-phenyl)-1H-indazole-4-carboxylic acid (6-methanesulfonyl-pyridin-3-ylmethyl)-amide
CID 44469804
N-[[3-(dimethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide
CID 44469942
1-(4-fluorophenyl)-N-[[4-(propan-2-ylsulfamoyl)phenyl]methyl]indazole-4-carboxamide
CID 44470083
1-(4-fluorophenyl)-N-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]methyl]indazole-4-carboxamide
CID 44470374
1-(4-Fluoro-phenyl)-1H-indazole-4-carboxylic acid 4-methylsulfamoyl-benzylamide
CID 58138789
1-(4-fluorophenyl)-N-[[3-(methylsulfamoyl)phenyl]methyl]indazole-4-carboxamide
CID 58138841
N-[[3-(ethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide
CID 58138852
N-[[4-(dimethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide
CID 58138880
1-(4-fluorophenyl)-N-[[3-(propan-2-ylsulfamoyl)phenyl]methyl]indazole-4-carboxamide
CID 58138893
1-(4-fluorophenyl)-N-[[4-(methylsulfamoyl)phenyl]methyl]pyrazolo[5,4-c]pyridine-4-carboxamide
CID 59278436
2-pyridin-2-yl-N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide
CID 68230705
4-[[[3-(1-methylpyrazol-3-yl)phenyl]sulfonylamino]methyl]-N-pyridin-3-ylbenzamide
CID 70654733

Frequently Asked Questions

What is the IUPAC name of 6-(dimethylsulfamoyl)-N-[2-methyl-5-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of 6-(dimethylsulfamoyl)-N-[2-methyl-5-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide (CID 16662084) is 6-(dimethylsulfamoyl)-N-[2-methyl-5-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for 6-(dimethylsulfamoyl)-N-[2-methyl-5-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for 6-(dimethylsulfamoyl)-N-[2-methyl-5-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide is Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)c1cnn2cc(S(=O)(=O)N(C)C)ccc12.
What is the InChIKey of 6-(dimethylsulfamoyl)-N-[2-methyl-5-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The InChIKey is FNLOOMKOQOZFEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H22F3N5O4S/c1-15-7-8-16(23(34)30-18-6-4-5-17(12-18)25(26,27)28)11-21(15)31-24(35)20-13-29-33-14-19(9-10-22(20)33)38(36,37)32(2)3/h4-14H,1-3H3,(H,30,34)(H,31,35).
What are the key properties of 6-(dimethylsulfamoyl)-N-[2-methyl-5-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
6-(dimethylsulfamoyl)-N-[2-methyl-5-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 545.54 g/mol, XLogP of 4.42, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(dimethylsulfamoyl)-N-[2-methyl-5-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 16662084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).