N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]acetamide

C26H25FN6O2 — CID 176654473

IUPACN-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]acetamide
SMILESCn1cc(-c2ccc3c(-c4ccc(CC(=O)Nc5cc(C(C)(C)C)on5)c(F)c4)cnn3c2)cn1
InChIInChI=1S/C26H25FN6O2/c1-26(2,3)23-11-24(31-35-23)30-25(34)10-17-6-5-16(9-21(17)27)20-13-29-33-15-18(7-8-22(20)33)19-12-28-32(4)14-19/h5-9,11-15H,10H2,1-4H3,(H,30,31,34)
InChIKeyCSCIUDVNPMTEHF-UHFFFAOYSA-N
MW472.52 g/mol
LogP5.01
Rot. Bonds5

About N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]acetamide

N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]acetamide (PubChem CID 176654473) has the molecular formula C26H25FN6O2 and a molecular weight of 472.52 g/mol. Its IUPAC name is N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]acetamide.

Molecular Properties

Compound NameN-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]acetamide
PubChem CID176654473
Molecular FormulaC26H25FN6O2
Molecular Weight472.52 g/mol
Exact Mass472.20
IUPAC NameN-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]acetamide
SMILESCn1cc(-c2ccc3c(-c4ccc(CC(=O)Nc5cc(C(C)(C)C)on5)c(F)c4)cnn3c2)cn1
InChIInChI=1S/C26H25FN6O2/c1-26(2,3)23-11-24(31-35-23)30-25(34)10-17-6-5-16(9-21(17)27)20-13-29-33-15-18(7-8-22(20)33)19-12-28-32(4)14-19/h5-9,11-15H,10H2,1-4H3,(H,30,31,34)
InChIKeyCSCIUDVNPMTEHF-UHFFFAOYSA-N
XLogP5.01
TPSA90.25 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500472.52
LogP ≤ 55.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]acetamide with MolForge

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Related Compounds

N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-3-yl]phenyl]acetamide
CID 165109119
N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[2-(pyrazolo[1,5-a]pyridin-3-ylamino)pyrimidin-5-yl]phenyl]acetamide
CID 126504977
1-tert-butyl-N-[[2-fluoro-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]phenyl]methyl]pyrazole-3-carboxamide
CID 168885315
N-[[2-fluoro-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]phenyl]methyl]-5-(1-methylcyclopropyl)-1,2,4-oxadiazole-3-carboxamide
CID 168885070
3-tert-butyl-N-[[2-fluoro-4-[2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]phenyl]methyl]-1,2,4-oxadiazole-5-carboxamide
CID 121249896
N-[3-(3,5-difluoro-2-pyridinyl)-5-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]cyclopropanesulfonamide
CID 155403297
3-(2,4-difluorophenyl)-5-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-N-propan-2-ylaniline
CID 155403295
3-tert-butyl-N-[[2-methoxy-4-[6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]phenyl]methyl]-1,2,4-oxadiazole-5-carboxamide;hydrochloride
CID 176883681
3-tert-butylimino-2-hydrazinylidene-N-[[2-methyl-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]phenyl]methyl]propanamide
CID 174067421
3-(cyclopropylsulfonylmethyl)-5-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]phenol
CID 167614558
6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 141364751
1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)-3-[2-fluoro-4-[2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]phenyl]propan-1-one
CID 149130542

Frequently Asked Questions

What is the IUPAC name of N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]acetamide?
The IUPAC name of N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]acetamide (CID 176654473) is N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]acetamide.
What is the SMILES notation for N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]acetamide?
The canonical SMILES for N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]acetamide is Cn1cc(-c2ccc3c(-c4ccc(CC(=O)Nc5cc(C(C)(C)C)on5)c(F)c4)cnn3c2)cn1.
What is the InChIKey of N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]acetamide?
The InChIKey is CSCIUDVNPMTEHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25FN6O2/c1-26(2,3)23-11-24(31-35-23)30-25(34)10-17-6-5-16(9-21(17)27)20-13-29-33-15-18(7-8-22(20)33)19-12-28-32(4)14-19/h5-9,11-15H,10H2,1-4H3,(H,30,31,34).
What are the key properties of N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]acetamide?
N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]acetamide has a molecular weight of 472.52 g/mol, XLogP of 5.01, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]phenyl]acetamide is sourced from PubChem (CID 176654473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).