6-(2-aminopyrimidin-4-yl)oxy-N-[4-fluoro-3-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide

C19H12F4N6O2 — CID 24763377

IUPAC6-(2-aminopyrimidin-4-yl)oxy-N-[4-fluoro-3-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESNc1nccc(Oc2ccc3c(C(=O)Nc4ccc(F)c(C(F)(F)F)c4)cnn3c2)n1
InChIInChI=1S/C19H12F4N6O2/c20-14-3-1-10(7-13(14)19(21,22)23)27-17(30)12-8-26-29-9-11(2-4-15(12)29)31-16-5-6-25-18(24)28-16/h1-9H,(H,27,30)(H2,24,25,28)
InChIKeyDLWFHHHBSJIBJM-UHFFFAOYSA-N
MW432.34 g/mol
LogP3.91
Rot. Bonds4

About 6-(2-aminopyrimidin-4-yl)oxy-N-[4-fluoro-3-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide

6-(2-aminopyrimidin-4-yl)oxy-N-[4-fluoro-3-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 24763377) has the molecular formula C19H12F4N6O2 and a molecular weight of 432.34 g/mol. Its IUPAC name is 6-(2-aminopyrimidin-4-yl)oxy-N-[4-fluoro-3-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(2-aminopyrimidin-4-yl)oxy-N-[4-fluoro-3-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide
PubChem CID24763377
Molecular FormulaC19H12F4N6O2
Molecular Weight432.34 g/mol
Exact Mass432.10
IUPAC Name6-(2-aminopyrimidin-4-yl)oxy-N-[4-fluoro-3-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESNc1nccc(Oc2ccc3c(C(=O)Nc4ccc(F)c(C(F)(F)F)c4)cnn3c2)n1
InChIInChI=1S/C19H12F4N6O2/c20-14-3-1-10(7-13(14)19(21,22)23)27-17(30)12-8-26-29-9-11(2-4-15(12)29)31-16-5-6-25-18(24)28-16/h1-9H,(H,27,30)(H2,24,25,28)
InChIKeyDLWFHHHBSJIBJM-UHFFFAOYSA-N
XLogP3.91
TPSA107.43 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.34
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

6-(2-aminopyrimidin-4-yl)oxy-N-[4-fluoro-3-(trifluoromethyl)phenyl]-1,2-benzothiazole-3-carboxamide
CID 24762705
6-(2-aminopyrimidin-4-yl)oxy-N-[4-methyl-3-(trifluoromethyl)phenyl]naphthalene-1-carboxamide
CID 67406449
methyl 6-(2-amino-6-chloropyrimidin-4-yl)oxypyrazolo[1,5-a]pyridine-3-carboxylate
CID 86626630
1-[4-fluoro-3-(trifluoromethyl)phenyl]-3-(4-pyrimidin-4-yloxyphenyl)urea
CID 25231150
4-amino-N-[4-fluoro-3-(trifluoromethyl)phenyl]pyridine-2-carboxamide
CID 62159635
1-[4-(2-aminopyrimidin-4-yl)oxyphenyl]-3-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]urea
CID 11477833
5-amino-N-[4-fluoro-3-(trifluoromethyl)phenyl]pyridine-2-carboxamide
CID 81312479
6-(2-amino-6-chloropyrimidin-4-yl)oxy-N-[4-fluoro-3-(trifluoromethyl)phenyl]-1,2-benzothiazole-3-carboxamide
CID 86626625
N-[4-fluoro-3-(trifluoromethyl)phenyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide
CID 122687083
2,5-difluoro-N-[4-fluoro-3-(trifluoromethyl)phenyl]benzamide
CID 28560319
6-(2-aminopyrimidin-4-yl)oxy-N-[3-(trifluoromethoxy)phenyl]-1-benzofuran-3-carboxamide
CID 24762797
1-[4-(2-aminopyrimidin-4-yl)oxyphenyl]-3-phenylurea
CID 22936793

Frequently Asked Questions

What is the IUPAC name of 6-(2-aminopyrimidin-4-yl)oxy-N-[4-fluoro-3-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of 6-(2-aminopyrimidin-4-yl)oxy-N-[4-fluoro-3-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide (CID 24763377) is 6-(2-aminopyrimidin-4-yl)oxy-N-[4-fluoro-3-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for 6-(2-aminopyrimidin-4-yl)oxy-N-[4-fluoro-3-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for 6-(2-aminopyrimidin-4-yl)oxy-N-[4-fluoro-3-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide is Nc1nccc(Oc2ccc3c(C(=O)Nc4ccc(F)c(C(F)(F)F)c4)cnn3c2)n1.
What is the InChIKey of 6-(2-aminopyrimidin-4-yl)oxy-N-[4-fluoro-3-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The InChIKey is DLWFHHHBSJIBJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12F4N6O2/c20-14-3-1-10(7-13(14)19(21,22)23)27-17(30)12-8-26-29-9-11(2-4-15(12)29)31-16-5-6-25-18(24)28-16/h1-9H,(H,27,30)(H2,24,25,28).
What are the key properties of 6-(2-aminopyrimidin-4-yl)oxy-N-[4-fluoro-3-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
6-(2-aminopyrimidin-4-yl)oxy-N-[4-fluoro-3-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 432.34 g/mol, XLogP of 3.91, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-aminopyrimidin-4-yl)oxy-N-[4-fluoro-3-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 24763377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).