2,2,2-trifluoro-N-[1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2R)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2S)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide

C45H48F9N9O6 — CID 158799662

IUPAC2,2,2-trifluoro-N-[1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2R)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2S)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide
SMILESCC(C)c1nn2ccccc2c1C(=O)[C@@H](C)NC(=O)C(F)(F)F.CC(C)c1nn2ccccc2c1C(=O)[C@H](C)NC(=O)C(F)(F)F.CC(NC(=O)C(F)(F)F)C(=O)c1c(C(C)C)nn2ccccc12
InChIInChI=1S/3C15H16F3N3O2/c3*1-8(2)12-11(10-6-4-5-7-21(10)20-12)13(22)9(3)19-14(23)15(16,17)18/h3*4-9H,1-3H3,(H,19,23)/t2*9-;/m10./s1
InChIKeyITHYEBDVJZTDRS-LSNJKTGPSA-N
MW981.92 g/mol
LogP8.12
Rot. Bonds12

About 2,2,2-trifluoro-N-[1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2R)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2S)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide

2,2,2-trifluoro-N-[1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2R)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2S)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide (PubChem CID 158799662) has the molecular formula C45H48F9N9O6 and a molecular weight of 981.92 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-[1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2R)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2S)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide.

Molecular Properties

Compound Name2,2,2-trifluoro-N-[1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2R)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2S)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide
PubChem CID158799662
Molecular FormulaC45H48F9N9O6
Molecular Weight981.92 g/mol
Exact Mass981.36
IUPAC Name2,2,2-trifluoro-N-[1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2R)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2S)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide
SMILESCC(C)c1nn2ccccc2c1C(=O)[C@@H](C)NC(=O)C(F)(F)F.CC(C)c1nn2ccccc2c1C(=O)[C@H](C)NC(=O)C(F)(F)F.CC(NC(=O)C(F)(F)F)C(=O)c1c(C(C)C)nn2ccccc12
InChIInChI=1S/3C15H16F3N3O2/c3*1-8(2)12-11(10-6-4-5-7-21(10)20-12)13(22)9(3)19-14(23)15(16,17)18/h3*4-9H,1-3H3,(H,19,23)/t2*9-;/m10./s1
InChIKeyITHYEBDVJZTDRS-LSNJKTGPSA-N
XLogP8.12
TPSA190.41 Ų
H-Bond Donors3
H-Bond Acceptors12
Rotatable Bonds12
Heavy Atoms69
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500981.92
LogP ≤ 58.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1012

Analyze 2,2,2-trifluoro-N-[1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2R)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2S)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide with MolForge

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Related Compounds

1-[(3R)-4-benzoyl-3-methyl-piperazin-1-yl]-2-[7-(triazol-2-yl)-1H-pyrrolo[3,2-b]pyridin-3-yl]ethane-1,2-dione
CID 15958913
1-[(3R)-4-benzoyl-3-methyl-piperazin-1-yl]-2-[7-(3-methylpyrazol-1-yl)-1H-pyrrolo[3,2-b]pyridin-3-yl]ethane-1,2-dione
CID 15958914
N-[2-methyl-5-[[2-(4-methylpiperazin-1-yl)phenyl]methylcarbamoyl]-3-pyridinyl]-6-(2-methylpyrazol-3-yl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 71283495
N-(5-(2-(2,2-dimethylpyrrolidin-1-yl)ethylcarbamoyl)-2-methylpyridin-3-yl)-6-(1-methyl-1H-pyrazol-4-yl)pyrazolo(1,5-a)pyridine-3-carboxamide
CID 71283628
(4-Fluoro-4-(((5-methylpyridin-2-yl)methylamino)methyl)piperidin-1-yl)(pyrazolo[1,5-a]pyridin-3-yl)methanone
CID 42606688
N-[2-fluoro-5-[[2-(4-methylpiperazin-1-yl)phenyl]methylcarbamoyl]phenyl]-6-(2-methylpyrazol-3-yl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 71283371
N-[5-(1-propan-2-ylpyrrolo[3,2-c]pyridine-3-carbonyl)-3-pyridinyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide
CID 121231190
2-(3-cyclopropylpyrazol-1-yl)-N-[5-(1-propan-2-ylpyrrolo[3,2-c]pyridine-3-carbonyl)-3-pyridinyl]acetamide
CID 121231195
2-(3-cyclopropylpyrazol-1-yl)-N-[5-(7-fluoro-1-propan-2-ylpyrrolo[3,2-c]pyridine-3-carbonyl)-3-pyridinyl]acetamide
CID 121231246
2,5-dimethyl-N-[[4-[4-(trifluoromethyl)piperidin-1-yl]phenyl]methyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 122188590
4-[[(3S,4S)-1-(2-cyanoacetyl)-4-methylpyrrolidin-3-yl]amino]-6-(2-fluoro-4-pyridinyl)pyrrolo[1,2-b]pyridazine-3-carboxamide
CID 91937374
6-(3-cyanopyrrolo[1,2-b] pyridazin-7-yl)-N-((R)-2-fluoro-3-hydroxy-3-methylbutyl)-4-((1-((R)-pyrrolidin-3-yl)-1H-pyrazol-4-yl)amino) nicotinamide
CID 135307941

Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-[1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2R)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2S)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide?
The IUPAC name of 2,2,2-trifluoro-N-[1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2R)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2S)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide (CID 158799662) is 2,2,2-trifluoro-N-[1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2R)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2S)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide.
What is the SMILES notation for 2,2,2-trifluoro-N-[1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2R)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2S)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide?
The canonical SMILES for 2,2,2-trifluoro-N-[1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2R)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2S)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide is CC(C)c1nn2ccccc2c1C(=O)[C@@H](C)NC(=O)C(F)(F)F.CC(C)c1nn2ccccc2c1C(=O)[C@H](C)NC(=O)C(F)(F)F.CC(NC(=O)C(F)(F)F)C(=O)c1c(C(C)C)nn2ccccc12.
What is the InChIKey of 2,2,2-trifluoro-N-[1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2R)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2S)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide?
The InChIKey is ITHYEBDVJZTDRS-LSNJKTGPSA-N. The full InChI is InChI=1S/3C15H16F3N3O2/c3*1-8(2)12-11(10-6-4-5-7-21(10)20-12)13(22)9(3)19-14(23)15(16,17)18/h3*4-9H,1-3H3,(H,19,23)/t2*9-;/m10./s1.
What are the key properties of 2,2,2-trifluoro-N-[1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2R)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2S)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide?
2,2,2-trifluoro-N-[1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2R)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2S)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide has a molecular weight of 981.92 g/mol, XLogP of 8.12, 12 rotatable bonds, 3 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-[1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2R)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide;2,2,2-trifluoro-N-[(2S)-1-oxo-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide is sourced from PubChem (CID 158799662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).