N-(3-fluoro-4-pyrazolo[1,5-a]pyridin-4-yloxyphenyl)-3-methyl-1-phenylpyrazole-4-carboxamide

C24H18FN5O2 — CID 118203847

IUPACN-(3-fluoro-4-pyrazolo[1,5-a]pyridin-4-yloxyphenyl)-3-methyl-1-phenylpyrazole-4-carboxamide
SMILESCc1nn(-c2ccccc2)cc1C(=O)Nc1ccc(Oc2cccn3nccc23)c(F)c1
InChIInChI=1S/C24H18FN5O2/c1-16-19(15-30(28-16)18-6-3-2-4-7-18)24(31)27-17-9-10-22(20(25)14-17)32-23-8-5-13-29-21(23)11-12-26-29/h2-15H,1H3,(H,27,31)
InChIKeyDOXJWNZVJXYEGK-UHFFFAOYSA-N
MW427.44 g/mol
LogP5.01
Rot. Bonds5

About N-(3-fluoro-4-pyrazolo[1,5-a]pyridin-4-yloxyphenyl)-3-methyl-1-phenylpyrazole-4-carboxamide

N-(3-fluoro-4-pyrazolo[1,5-a]pyridin-4-yloxyphenyl)-3-methyl-1-phenylpyrazole-4-carboxamide (PubChem CID 118203847) has the molecular formula C24H18FN5O2 and a molecular weight of 427.44 g/mol. Its IUPAC name is N-(3-fluoro-4-pyrazolo[1,5-a]pyridin-4-yloxyphenyl)-3-methyl-1-phenylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(3-fluoro-4-pyrazolo[1,5-a]pyridin-4-yloxyphenyl)-3-methyl-1-phenylpyrazole-4-carboxamide
PubChem CID118203847
Molecular FormulaC24H18FN5O2
Molecular Weight427.44 g/mol
Exact Mass427.14
IUPAC NameN-(3-fluoro-4-pyrazolo[1,5-a]pyridin-4-yloxyphenyl)-3-methyl-1-phenylpyrazole-4-carboxamide
SMILESCc1nn(-c2ccccc2)cc1C(=O)Nc1ccc(Oc2cccn3nccc23)c(F)c1
InChIInChI=1S/C24H18FN5O2/c1-16-19(15-30(28-16)18-6-3-2-4-7-18)24(31)27-17-9-10-22(20(25)14-17)32-23-8-5-13-29-21(23)11-12-26-29/h2-15H,1H3,(H,27,31)
InChIKeyDOXJWNZVJXYEGK-UHFFFAOYSA-N
XLogP5.01
TPSA73.45 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500427.44
LogP ≤ 55.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-[(2E,4E)-5-fluoro-2-methylhexa-2,4-dienyl]-N-(3-fluoro-4-pyrazolo[1,5-a]pyridin-4-yloxyphenyl)-2-oxopyridine-3-carboxamide
CID 134423684
1-(4-fluorophenyl)-N-(3-fluoro-4-pyrrolo[1,2-b]pyridazin-4-yloxyphenyl)-2,3-dimethyl-5-oxopyrazole-4-carboxamide
CID 46194994
1-(4-fluorophenyl)-N-[3-fluoro-4-(6-pyridin-4-ylpyrazolo[1,5-a]pyridin-4-yl)oxyphenyl]-2-oxopyridine-3-carboxamide
CID 118203931
1-(4-fluorophenyl)-N-[3-fluoro-4-[6-(1H-pyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]oxyphenyl]-2-oxopyridine-3-carboxamide
CID 118197847
N-[3-fluoro-4-[[(2S)-oxolan-2-yl]methylamino]phenyl]-3-methyl-1-phenylpyrazole-4-carboxamide
CID 99626102
1-ethyl-3-(4-fluorophenyl)-N-[3-fluoro-4-(6-pyrrolidin-1-ylpyrazolo[1,5-a]pyridin-4-yl)oxyphenyl]-2,4-dioxopyrimidine-5-carboxamide
CID 134555924
N-[4-[6-(3,3-difluoro-2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-4-yl]oxy-3-fluorophenyl]-1-ethyl-3-(4-fluorophenyl)-2,4-dioxopyrimidine-5-carboxamide
CID 142733839
1-ethyl-3-(4-fluorophenyl)-N-[3-fluoro-4-[6-(1,3-thiazol-5-yl)pyrazolo[1,5-a]pyridin-4-yl]oxyphenyl]-2,4-dioxopyrimidine-5-carboxamide
CID 118203809
2-[3-fluoro-4-[6-(1-methylimidazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]oxyanilino]-N-phenylpyridine-3-carboxamide
CID 118197732
4-fluorobenzamide;3-fluoro-4-pyrazolo[1,5-a]pyridin-4-yloxybenzamide
CID 118197886
4-[2-fluoro-4-[[3-(4-fluorophenyl)-2,4-dioxo-1-propan-2-ylpyrimidine-5-carbonyl]amino]phenoxy]-N,N-dimethylpyrazolo[1,5-a]pyridine-6-carboxamide
CID 118203827
N-(4-fluorophenyl)-3-(2-methoxyphenyl)-1-phenylpyrazole-4-carboxamide
CID 8744666

Frequently Asked Questions

What is the IUPAC name of N-(3-fluoro-4-pyrazolo[1,5-a]pyridin-4-yloxyphenyl)-3-methyl-1-phenylpyrazole-4-carboxamide?
The IUPAC name of N-(3-fluoro-4-pyrazolo[1,5-a]pyridin-4-yloxyphenyl)-3-methyl-1-phenylpyrazole-4-carboxamide (CID 118203847) is N-(3-fluoro-4-pyrazolo[1,5-a]pyridin-4-yloxyphenyl)-3-methyl-1-phenylpyrazole-4-carboxamide.
What is the SMILES notation for N-(3-fluoro-4-pyrazolo[1,5-a]pyridin-4-yloxyphenyl)-3-methyl-1-phenylpyrazole-4-carboxamide?
The canonical SMILES for N-(3-fluoro-4-pyrazolo[1,5-a]pyridin-4-yloxyphenyl)-3-methyl-1-phenylpyrazole-4-carboxamide is Cc1nn(-c2ccccc2)cc1C(=O)Nc1ccc(Oc2cccn3nccc23)c(F)c1.
What is the InChIKey of N-(3-fluoro-4-pyrazolo[1,5-a]pyridin-4-yloxyphenyl)-3-methyl-1-phenylpyrazole-4-carboxamide?
The InChIKey is DOXJWNZVJXYEGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18FN5O2/c1-16-19(15-30(28-16)18-6-3-2-4-7-18)24(31)27-17-9-10-22(20(25)14-17)32-23-8-5-13-29-21(23)11-12-26-29/h2-15H,1H3,(H,27,31).
What are the key properties of N-(3-fluoro-4-pyrazolo[1,5-a]pyridin-4-yloxyphenyl)-3-methyl-1-phenylpyrazole-4-carboxamide?
N-(3-fluoro-4-pyrazolo[1,5-a]pyridin-4-yloxyphenyl)-3-methyl-1-phenylpyrazole-4-carboxamide has a molecular weight of 427.44 g/mol, XLogP of 5.01, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoro-4-pyrazolo[1,5-a]pyridin-4-yloxyphenyl)-3-methyl-1-phenylpyrazole-4-carboxamide is sourced from PubChem (CID 118203847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).