6-(5-fluoro-3-pyridinyl)-N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-(5-propan-2-yloxy-3-pyridinyl)pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxamide

C70H58F4N18O7 — CID 158792826

IUPAC6-(5-fluoro-3-pyridinyl)-N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-(5-propan-2-yloxy-3-pyridinyl)pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxamide
SMILESCC(C)Oc1cncc(-c2cccc(C(=O)Nc3cn(C4COC4)nc3-c3ccccn3)n2)c1.O=C(Nc1cn(C2COC2)nc1-c1ccccn1)c1cccc(-c2cncc(C(F)(F)F)c2)n1.O=C(Nc1cn(C2COC2)nc1-c1ccccn1)c1cccc(-c2cncc(F)c2)n1
InChIInChI=1S/C25H24N6O3.C23H17F3N6O2.C22H17FN6O2/c1-16(2)34-19-10-17(11-26-12-19)20-7-5-8-22(28-20)25(32)29-23-13-31(18-14-33-15-18)30-24(23)21-6-3-4-9-27-21;24-23(25,26)15-8-14(9-27-10-15)17-5-3-6-19(29-17)22(33)30-20-11-32(16-12-34-13-16)31-21(20)18-4-1-2-7-28-18;23-15-8-14(9-24-10-15)17-5-3-6-19(26-17)22(30)27-20-11-29(16-12-31-13-16)28-21(20)18-4-1-2-7-25-18/h3-13,16,18H,14-15H2,1-2H3,(H,29,32);1-11,16H,12-13H2,(H,30,33);1-11,16H,12-13H2,(H,27,30)
InChIKeyISMLASJZYWSGSP-UHFFFAOYSA-N
MW1339.34 g/mol
LogP11.62
Rot. Bonds17

About 6-(5-fluoro-3-pyridinyl)-N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-(5-propan-2-yloxy-3-pyridinyl)pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxamide

6-(5-fluoro-3-pyridinyl)-N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-(5-propan-2-yloxy-3-pyridinyl)pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxamide (PubChem CID 158792826) has the molecular formula C70H58F4N18O7 and a molecular weight of 1339.34 g/mol. Its IUPAC name is 6-(5-fluoro-3-pyridinyl)-N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-(5-propan-2-yloxy-3-pyridinyl)pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-(5-fluoro-3-pyridinyl)-N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-(5-propan-2-yloxy-3-pyridinyl)pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxamide
PubChem CID158792826
Molecular FormulaC70H58F4N18O7
Molecular Weight1339.34 g/mol
Exact Mass1338.47
IUPAC Name6-(5-fluoro-3-pyridinyl)-N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-(5-propan-2-yloxy-3-pyridinyl)pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxamide
SMILESCC(C)Oc1cncc(-c2cccc(C(=O)Nc3cn(C4COC4)nc3-c3ccccn3)n2)c1.O=C(Nc1cn(C2COC2)nc1-c1ccccn1)c1cccc(-c2cncc(C(F)(F)F)c2)n1.O=C(Nc1cn(C2COC2)nc1-c1ccccn1)c1cccc(-c2cncc(F)c2)n1
InChIInChI=1S/C25H24N6O3.C23H17F3N6O2.C22H17FN6O2/c1-16(2)34-19-10-17(11-26-12-19)20-7-5-8-22(28-20)25(32)29-23-13-31(18-14-33-15-18)30-24(23)21-6-3-4-9-27-21;24-23(25,26)15-8-14(9-27-10-15)17-5-3-6-19(29-17)22(33)30-20-11-32(16-12-34-13-16)31-21(20)18-4-1-2-7-28-18;23-15-8-14(9-24-10-15)17-5-3-6-19(26-17)22(30)27-20-11-29(16-12-31-13-16)28-21(20)18-4-1-2-7-25-18/h3-13,16,18H,14-15H2,1-2H3,(H,29,32);1-11,16H,12-13H2,(H,30,33);1-11,16H,12-13H2,(H,27,30)
InChIKeyISMLASJZYWSGSP-UHFFFAOYSA-N
XLogP11.62
TPSA293.69 Ų
H-Bond Donors3
H-Bond Acceptors22
Rotatable Bonds17
Heavy Atoms99
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001339.34
LogP ≤ 511.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1022

Analyze 6-(5-fluoro-3-pyridinyl)-N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-(5-propan-2-yloxy-3-pyridinyl)pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxamide with MolForge

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Related Compounds

N-[5-[6-(2,2-difluoroethoxy)-5-morpholin-4-ylpyridazin-3-yl]-6-methylpyridin-3-yl]-4-(trifluoromethyl)pyridine-2-carboxamide
CID 90456521
N-[6-methyl-5-[5-morpholin-4-yl-6-(oxan-4-yloxy)pyridazin-3-yl]pyridin-3-yl]-4-(trifluoromethyl)pyridine-2-carboxamide
CID 90461189
[6-[[2-fluoro-4-[[5-(5-methylpyrazine-2-carbonyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methoxy]phenyl]methyl]-3-pyridinyl]-[2-[(3-fluorophenoxy)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone
CID 123173683
N-[5-[5-[2-[[6-[5-[[2-(1,1-difluoropropyl)pyridine-4-carbonyl]amino]-2-methylpyridin-3-yl]-4-morpholin-4-ylpyridazin-3-yl]oxymethyl]morpholin-4-yl]-6-methoxypyridazin-3-yl]-6-methylpyridin-3-yl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide
CID 130425800
N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)-6-[5-(2,2,2-trifluoroethoxy)pyridin-3-yl]pyridine-2-carboxamide
CID 134450214
N-(1-methyl-3-pyrazin-2-ylpyrazol-4-yl)-6-[5-(2,2,2-trifluoroethoxy)pyridin-3-yl]pyridine-2-carboxamide
CID 134450279
6-(5-aminopyridin-3-yl)-N-[3-[5-[[4-[[6-[5-(methylamino)pyridin-3-yl]pyridine-2-carbonyl]amino]-3-pyridin-2-ylpyrazol-1-yl]methyl]pyridin-2-yl]-1-[[6-[1-methyl-4-[[6-[5-(2,2,2-trifluoroethoxy)pyridin-3-yl]pyridine-2-carbonyl]amino]pyrazol-3-yl]pyridin-2-yl]methyl]pyrazol-4-yl]pyridine-2-carboxamide
CID 134453065
5-[4-[5-[2-[3-[4-(5-methoxypyridin-3-yl)triazol-1-yl]-5-[[3-(pyrrolidin-1-ylmethyl)-5-(trifluoromethyl)phenyl]carbamoyl]pyridin-2-yl]ethoxy]pyridin-3-yl]triazol-1-yl]-N-[4-methoxy-3-(trifluoromethyl)phenyl]-6-methylpyridine-3-carboxamide
CID 143962173
2-(1,1-difluoroethyl)-N-[6-methyl-5-[5-morpholin-4-yl-6-(oxan-4-yloxy)pyridazin-3-yl]-3-pyridinyl]pyridine-4-carboxamide;6-methyl-5-[5-morpholin-4-yl-6-(oxan-4-yloxy)pyridazin-3-yl]pyridin-3-amine
CID 144717437
N-ethyl-2-[1-[4-[ethyl-[(2S)-1-[[5-(trifluoromethyl)-2-pyridinyl]oxy]propan-2-yl]carbamoyl]-5-fluoro-3-pyridinyl]pyrazol-3-yl]-5-pyrazol-1-yl-N-[(2S)-1-[[5-(trifluoromethyl)-2-pyridinyl]oxy]propan-2-yl]pyridine-4-carboxamide
CID 155048130
N-ethyl-6-[2-[2-[ethyl-[(2S)-1-[[3-fluoro-5-(trifluoromethyl)-2-pyridinyl]oxy]propan-2-yl]carbamoyl]-3-pyridinyl]triazol-4-yl]-3-(triazol-2-yl)-N-[(2S)-1-[[5-(trifluoromethyl)-2-pyridinyl]oxy]propan-2-yl]pyridine-2-carboxamide
CID 155048134
1-benzyl-N-[(1S)-2-(3,5-difluorophenyl)-1-[3-[4-fluoro-3-(methylcarbamoyl)phenyl]-2-pyridinyl]ethyl]pyrrolidine-2-carboxamide;5-[2-[(1S)-1-[[2-[5-cyclopentyl-3-(trifluoromethyl)pyrazol-1-yl]acetyl]amino]-2-(3,5-difluorophenyl)ethyl]-3-pyridinyl]-2-fluoro-N-methylbenzamide;(2S)-N-[(1S)-2-(3,5-difluorophenyl)-1-[3-[4-fluoro-3-(methylcarbamoyl)phenyl]-2-pyridinyl]ethyl]-4-oxopyrrolidine-2-carboxamide;(2S,4S)-N-[(1S)-2-(3,5-difluorophenyl)-1-[3-[4-fluoro-3-(methylcarbamoyl)phenyl]-2-pyridinyl]ethyl]-4-phenoxypyrrolidine-2-carboxamide
CID 157382262

Frequently Asked Questions

What is the IUPAC name of 6-(5-fluoro-3-pyridinyl)-N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-(5-propan-2-yloxy-3-pyridinyl)pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxamide?
The IUPAC name of 6-(5-fluoro-3-pyridinyl)-N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-(5-propan-2-yloxy-3-pyridinyl)pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxamide (CID 158792826) is 6-(5-fluoro-3-pyridinyl)-N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-(5-propan-2-yloxy-3-pyridinyl)pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxamide.
What is the SMILES notation for 6-(5-fluoro-3-pyridinyl)-N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-(5-propan-2-yloxy-3-pyridinyl)pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxamide?
The canonical SMILES for 6-(5-fluoro-3-pyridinyl)-N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-(5-propan-2-yloxy-3-pyridinyl)pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxamide is CC(C)Oc1cncc(-c2cccc(C(=O)Nc3cn(C4COC4)nc3-c3ccccn3)n2)c1.O=C(Nc1cn(C2COC2)nc1-c1ccccn1)c1cccc(-c2cncc(C(F)(F)F)c2)n1.O=C(Nc1cn(C2COC2)nc1-c1ccccn1)c1cccc(-c2cncc(F)c2)n1.
What is the InChIKey of 6-(5-fluoro-3-pyridinyl)-N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-(5-propan-2-yloxy-3-pyridinyl)pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxamide?
The InChIKey is ISMLASJZYWSGSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N6O3.C23H17F3N6O2.C22H17FN6O2/c1-16(2)34-19-10-17(11-26-12-19)20-7-5-8-22(28-20)25(32)29-23-13-31(18-14-33-15-18)30-24(23)21-6-3-4-9-27-21;24-23(25,26)15-8-14(9-27-10-15)17-5-3-6-19(29-17)22(33)30-20-11-32(16-12-34-13-16)31-21(20)18-4-1-2-7-28-18;23-15-8-14(9-24-10-15)17-5-3-6-19(26-17)22(30)27-20-11-29(16-12-31-13-16)28-21(20)18-4-1-2-7-25-18/h3-13,16,18H,14-15H2,1-2H3,(H,29,32);1-11,16H,12-13H2,(H,30,33);1-11,16H,12-13H2,(H,27,30).
What are the key properties of 6-(5-fluoro-3-pyridinyl)-N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-(5-propan-2-yloxy-3-pyridinyl)pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxamide?
6-(5-fluoro-3-pyridinyl)-N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-(5-propan-2-yloxy-3-pyridinyl)pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxamide has a molecular weight of 1339.34 g/mol, XLogP of 11.62, 17 rotatable bonds, 3 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-fluoro-3-pyridinyl)-N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-(5-propan-2-yloxy-3-pyridinyl)pyridine-2-carboxamide;N-[1-(oxetan-3-yl)-3-pyridin-2-ylpyrazol-4-yl]-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxamide is sourced from PubChem (CID 158792826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).