N-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-[4-fluoro-2-(trifluoromethyl)phenyl]acetamide

C23H17F4N5O2 — CID 162746862

IUPACN-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-[4-fluoro-2-(trifluoromethyl)phenyl]acetamide
SMILESCC(=O)N(c1ccn2nccc2c1)c1cc(NC(=O)Cc2ccc(F)cc2C(F)(F)F)ccn1
InChIInChI=1S/C23H17F4N5O2/c1-14(33)32(19-6-9-31-18(13-19)5-8-29-31)21-12-17(4-7-28-21)30-22(34)10-15-2-3-16(24)11-20(15)23(25,26)27/h2-9,11-13H,10H2,1H3,(H,28,30,34)
InChIKeySGUXOQBKNQEILV-UHFFFAOYSA-N
MW471.41 g/mol
LogP4.75
Rot. Bonds5

About N-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-[4-fluoro-2-(trifluoromethyl)phenyl]acetamide

N-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-[4-fluoro-2-(trifluoromethyl)phenyl]acetamide (PubChem CID 162746862) has the molecular formula C23H17F4N5O2 and a molecular weight of 471.41 g/mol. Its IUPAC name is N-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-[4-fluoro-2-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound NameN-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-[4-fluoro-2-(trifluoromethyl)phenyl]acetamide
PubChem CID162746862
Molecular FormulaC23H17F4N5O2
Molecular Weight471.41 g/mol
Exact Mass471.13
IUPAC NameN-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-[4-fluoro-2-(trifluoromethyl)phenyl]acetamide
SMILESCC(=O)N(c1ccn2nccc2c1)c1cc(NC(=O)Cc2ccc(F)cc2C(F)(F)F)ccn1
InChIInChI=1S/C23H17F4N5O2/c1-14(33)32(19-6-9-31-18(13-19)5-8-29-31)21-12-17(4-7-28-21)30-22(34)10-15-2-3-16(24)11-20(15)23(25,26)27/h2-9,11-13H,10H2,1H3,(H,28,30,34)
InChIKeySGUXOQBKNQEILV-UHFFFAOYSA-N
XLogP4.75
TPSA79.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500471.41
LogP ≤ 54.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-(2-chloro-3,4-difluorophenyl)acetamide
CID 162746509
N-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-(2-chlorophenyl)acetamide
CID 162746618
N-[2-(N-acetyl-4-fluoroanilino)-4-pyridinyl]-2-[2-(trifluoromethyl)phenyl]acetamide
CID 162428244
N-[2-(N-acetyl-3-fluoroanilino)-4-pyridinyl]-2-(2-chloro-4-fluorophenyl)acetamide;N-[2-(N-acetyl-3-fluoroanilino)-4-pyridinyl]-2-(2-chlorophenyl)acetamide
CID 175417454
N-[2-[acetyl-(2-methylpyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-(2-chlorophenyl)acetamide
CID 162746856
N-[2-[acetyl-(3-fluoro-4-pyridinyl)amino]-4-pyridinyl]-2-[2-chloro-3-(trifluoromethyl)phenyl]acetamide
CID 162746788
N-pyrazolo[1,5-a]pyridin-5-yl-2-[4-(trifluoromethyl)phenyl]acetamide
CID 86266864
N-[2-[acetyl-(2-methylbenzotriazol-5-yl)amino]-4-pyridinyl]-2-(2-chloro-3-fluorophenyl)acetamide
CID 162746556
N-[2-[acetyl(1,3-dihydro-2-benzofuran-5-yl)amino]-4-pyridinyl]-2-(2-chloro-3-fluorophenyl)acetamide
CID 162746490
N-[2-[acetyl-(4-methoxypyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-(2,6-dichlorophenyl)acetamide
CID 162746793
N-[2-[acetyl(pyridin-4-yl)amino]-4-pyridinyl]-2-(2,6-dichlorophenyl)acetamide
CID 162746510
N-[2-[acetyl(1,3-benzoxazol-6-yl)amino]-4-pyridinyl]-2-(2-chlorophenyl)acetamide
CID 162746899

Frequently Asked Questions

What is the IUPAC name of N-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-[4-fluoro-2-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of N-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-[4-fluoro-2-(trifluoromethyl)phenyl]acetamide (CID 162746862) is N-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-[4-fluoro-2-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for N-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-[4-fluoro-2-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for N-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-[4-fluoro-2-(trifluoromethyl)phenyl]acetamide is CC(=O)N(c1ccn2nccc2c1)c1cc(NC(=O)Cc2ccc(F)cc2C(F)(F)F)ccn1.
What is the InChIKey of N-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-[4-fluoro-2-(trifluoromethyl)phenyl]acetamide?
The InChIKey is SGUXOQBKNQEILV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17F4N5O2/c1-14(33)32(19-6-9-31-18(13-19)5-8-29-31)21-12-17(4-7-28-21)30-22(34)10-15-2-3-16(24)11-20(15)23(25,26)27/h2-9,11-13H,10H2,1H3,(H,28,30,34).
What are the key properties of N-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-[4-fluoro-2-(trifluoromethyl)phenyl]acetamide?
N-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-[4-fluoro-2-(trifluoromethyl)phenyl]acetamide has a molecular weight of 471.41 g/mol, XLogP of 4.75, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-[4-fluoro-2-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 162746862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).