N-(3,5-dichloro-4-pyridinyl)-7-methylsulfanyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide

C15H9Cl2F3N4OS — CID 59227413

IUPACN-(3,5-dichloro-4-pyridinyl)-7-methylsulfanyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide
SMILESCSc1ccc(C(=O)Nc2c(Cl)cncc2Cl)c2cc(C(F)(F)F)nn12
InChIInChI=1S/C15H9Cl2F3N4OS/c1-26-12-3-2-7(10-4-11(15(18,19)20)23-24(10)12)14(25)22-13-8(16)5-21-6-9(13)17/h2-6H,1H3,(H,21,22,25)
InChIKeyZVURGRBGOSQMCA-UHFFFAOYSA-N
MW421.23 g/mol
LogP5.03
Rot. Bonds3

About N-(3,5-dichloro-4-pyridinyl)-7-methylsulfanyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide

N-(3,5-dichloro-4-pyridinyl)-7-methylsulfanyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide (PubChem CID 59227413) has the molecular formula C15H9Cl2F3N4OS and a molecular weight of 421.23 g/mol. Its IUPAC name is N-(3,5-dichloro-4-pyridinyl)-7-methylsulfanyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(3,5-dichloro-4-pyridinyl)-7-methylsulfanyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide
PubChem CID59227413
Molecular FormulaC15H9Cl2F3N4OS
Molecular Weight421.23 g/mol
Exact Mass419.98
IUPAC NameN-(3,5-dichloro-4-pyridinyl)-7-methylsulfanyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide
SMILESCSc1ccc(C(=O)Nc2c(Cl)cncc2Cl)c2cc(C(F)(F)F)nn12
InChIInChI=1S/C15H9Cl2F3N4OS/c1-26-12-3-2-7(10-4-11(15(18,19)20)23-24(10)12)14(25)22-13-8(16)5-21-6-9(13)17/h2-6H,1H3,(H,21,22,25)
InChIKeyZVURGRBGOSQMCA-UHFFFAOYSA-N
XLogP5.03
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500421.23
LogP ≤ 55.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(3,5-dichloro-4-pyridinyl)-7-methylsulfanyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichloro-4-pyridinyl)-7-methylsulfanyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide?
The IUPAC name of N-(3,5-dichloro-4-pyridinyl)-7-methylsulfanyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide (CID 59227413) is N-(3,5-dichloro-4-pyridinyl)-7-methylsulfanyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide.
What is the SMILES notation for N-(3,5-dichloro-4-pyridinyl)-7-methylsulfanyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide?
The canonical SMILES for N-(3,5-dichloro-4-pyridinyl)-7-methylsulfanyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide is CSc1ccc(C(=O)Nc2c(Cl)cncc2Cl)c2cc(C(F)(F)F)nn12.
What is the InChIKey of N-(3,5-dichloro-4-pyridinyl)-7-methylsulfanyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide?
The InChIKey is ZVURGRBGOSQMCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9Cl2F3N4OS/c1-26-12-3-2-7(10-4-11(15(18,19)20)23-24(10)12)14(25)22-13-8(16)5-21-6-9(13)17/h2-6H,1H3,(H,21,22,25).
What are the key properties of N-(3,5-dichloro-4-pyridinyl)-7-methylsulfanyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide?
N-(3,5-dichloro-4-pyridinyl)-7-methylsulfanyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide has a molecular weight of 421.23 g/mol, XLogP of 5.03, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichloro-4-pyridinyl)-7-methylsulfanyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide is sourced from PubChem (CID 59227413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).