3-[3-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-5-yl]-N-methylaniline

C20H15ClFN3 — CID 53241653

IUPAC3-[3-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-5-yl]-N-methylaniline
SMILESCNc1cccc(-c2ccn3nc(-c4ccc(F)cc4)c(Cl)c3c2)c1
InChIInChI=1S/C20H15ClFN3/c1-23-17-4-2-3-14(11-17)15-9-10-25-18(12-15)19(21)20(24-25)13-5-7-16(22)8-6-13/h2-12,23H,1H3
InChIKeyJJNXGTTWHPMGGI-UHFFFAOYSA-N
MW351.81 g/mol
LogP5.50
Rot. Bonds3

About 3-[3-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-5-yl]-N-methylaniline

3-[3-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-5-yl]-N-methylaniline (PubChem CID 53241653) has the molecular formula C20H15ClFN3 and a molecular weight of 351.81 g/mol. Its IUPAC name is 3-[3-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-5-yl]-N-methylaniline.

Molecular Properties

Compound Name3-[3-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-5-yl]-N-methylaniline
PubChem CID53241653
Molecular FormulaC20H15ClFN3
Molecular Weight351.81 g/mol
Exact Mass351.09
IUPAC Name3-[3-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-5-yl]-N-methylaniline
SMILESCNc1cccc(-c2ccn3nc(-c4ccc(F)cc4)c(Cl)c3c2)c1
InChIInChI=1S/C20H15ClFN3/c1-23-17-4-2-3-14(11-17)15-9-10-25-18(12-15)19(21)20(24-25)13-5-7-16(22)8-6-13/h2-12,23H,1H3
InChIKeyJJNXGTTWHPMGGI-UHFFFAOYSA-N
XLogP5.50
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.81
LogP ≤ 55.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-[3-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-5-yl]-N-methylaniline 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

2-(4-fluorophenyl)-5-(3-formylphenyl)-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide
CID 88906215
3-bromo-5-phenyl-2-(4-phenylphenyl)pyrazolo[1,5-a]pyridine
CID 142726284
3-fluoro-N-methylaniline
CID 2759011
3-(2-fluoro-6-methoxyphenyl)-N-methylaniline
CID 70269151
3-(2-chloro-6-methyl-4-pyridinyl)-2-[3-(methylamino)phenyl]-N-piperidin-4-ylpyrazolo[1,5-a]pyrimidin-5-amine
CID 157038268
3-(4-fluorophenyl)-N-methyl-1H-indazol-5-amine
CID 71190825
2-(4-fluorophenyl)-3-[3-(4-fluorophenyl)phenyl]imidazo[1,2-a]pyridine
CID 71699551
N-methyl-3-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)aniline
CID 116989693
N-methyl-3-(1-methylpyrazol-4-yl)aniline
CID 106505763
3-fluoro-N-methylaniline;molecular hydrogen
CID 143398655
3-(2-chloro-5-methylthiophen-3-yl)-N-methylaniline
CID 142254687
3-(1H-indol-5-yl)-N-methylaniline
CID 116996135

Frequently Asked Questions

What is the IUPAC name of 3-[3-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-5-yl]-N-methylaniline?
The IUPAC name of 3-[3-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-5-yl]-N-methylaniline (CID 53241653) is 3-[3-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-5-yl]-N-methylaniline.
What is the SMILES notation for 3-[3-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-5-yl]-N-methylaniline?
The canonical SMILES for 3-[3-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-5-yl]-N-methylaniline is CNc1cccc(-c2ccn3nc(-c4ccc(F)cc4)c(Cl)c3c2)c1.
What is the InChIKey of 3-[3-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-5-yl]-N-methylaniline?
The InChIKey is JJNXGTTWHPMGGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15ClFN3/c1-23-17-4-2-3-14(11-17)15-9-10-25-18(12-15)19(21)20(24-25)13-5-7-16(22)8-6-13/h2-12,23H,1H3.
What are the key properties of 3-[3-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-5-yl]-N-methylaniline?
3-[3-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-5-yl]-N-methylaniline has a molecular weight of 351.81 g/mol, XLogP of 5.50, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-5-yl]-N-methylaniline is sourced from PubChem (CID 53241653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).