N-[6-(1-acetylpiperidin-4-yl)oxy-2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(1-methylpiperidin-4-yl)oxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(oxan-4-yloxy)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-piperidin-4-yloxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide

C109H127F12N19O12 — CID 164954252

IUPACN-[6-(1-acetylpiperidin-4-yl)oxy-2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(1-methylpiperidin-4-yl)oxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(oxan-4-yloxy)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-piperidin-4-yloxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
SMILESCC(=O)N1CCC(Oc2cc3nn(C4CC(C(C)(C)O)C4)cc3cc2NC(=O)c2cccc(C(F)(F)F)n2)CC1.CC(C)(C)C1CC(n2cc3cc(NC(=O)c4cccc(C(F)(F)F)n4)c(OC4CCOCC4)cc3n2)C1.CC(C)(O)C1CC(n2cc3cc(NC(=O)c4cccc(C(F)(F)F)n4)c(OC4CCNCC4)cc3n2)C1.CN1CCC(Oc2cc3nn(C4CC(C(C)(C)C)C4)cc3cc2NC(=O)c2cccc(C(F)(F)F)n2)CC1
InChIInChI=1S/C28H32F3N5O4.C28H34F3N5O2.C27H31F3N4O3.C26H30F3N5O3/c1-16(37)35-9-7-20(8-10-35)40-24-14-22-17(15-36(34-22)19-12-18(13-19)27(2,3)39)11-23(24)33-26(38)21-5-4-6-25(32-21)28(29,30)31;1-27(2,3)18-13-19(14-18)36-16-17-12-23(33-26(37)21-6-5-7-25(32-21)28(29,30)31)24(15-22(17)34-36)38-20-8-10-35(4)11-9-20;1-26(2,3)17-12-18(13-17)34-15-16-11-22(23(14-21(16)33-34)37-19-7-9-36-10-8-19)32-25(35)20-5-4-6-24(31-20)27(28,29)30;1-25(2,36)16-11-17(12-16)34-14-15-10-21(22(13-20(15)33-34)37-18-6-8-30-9-7-18)32-24(35)19-4-3-5-23(31-19)26(27,28)29/h4-6,11,14-15,18-20,39H,7-10,12-13H2,1-3H3,(H,33,38);5-7,12,15-16,18-20H,8-11,13-14H2,1-4H3,(H,33,37);4-6,11,14-15,17-19H,7-10,12-13H2,1-3H3,(H,32,35);3-5,10,13-14,16-18,30,36H,6-9,11-12H2,1-2H3,(H,32,35)
InChIKeyAYLPSQURWSNIND-UHFFFAOYSA-N
MW2123.31 g/mol
LogP21.80
Rot. Bonds22

About N-[6-(1-acetylpiperidin-4-yl)oxy-2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(1-methylpiperidin-4-yl)oxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(oxan-4-yloxy)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-piperidin-4-yloxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide

N-[6-(1-acetylpiperidin-4-yl)oxy-2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(1-methylpiperidin-4-yl)oxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(oxan-4-yloxy)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-piperidin-4-yloxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide (PubChem CID 164954252) has the molecular formula C109H127F12N19O12 and a molecular weight of 2123.31 g/mol. Its IUPAC name is N-[6-(1-acetylpiperidin-4-yl)oxy-2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(1-methylpiperidin-4-yl)oxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(oxan-4-yloxy)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-piperidin-4-yloxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[6-(1-acetylpiperidin-4-yl)oxy-2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(1-methylpiperidin-4-yl)oxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(oxan-4-yloxy)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-piperidin-4-yloxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
PubChem CID164954252
Molecular FormulaC109H127F12N19O12
Molecular Weight2123.31 g/mol
Exact Mass2121.97
IUPAC NameN-[6-(1-acetylpiperidin-4-yl)oxy-2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(1-methylpiperidin-4-yl)oxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(oxan-4-yloxy)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-piperidin-4-yloxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
SMILESCC(=O)N1CCC(Oc2cc3nn(C4CC(C(C)(C)O)C4)cc3cc2NC(=O)c2cccc(C(F)(F)F)n2)CC1.CC(C)(C)C1CC(n2cc3cc(NC(=O)c4cccc(C(F)(F)F)n4)c(OC4CCOCC4)cc3n2)C1.CC(C)(O)C1CC(n2cc3cc(NC(=O)c4cccc(C(F)(F)F)n4)c(OC4CCNCC4)cc3n2)C1.CN1CCC(Oc2cc3nn(C4CC(C(C)(C)C)C4)cc3cc2NC(=O)c2cccc(C(F)(F)F)n2)CC1
InChIInChI=1S/C28H32F3N5O4.C28H34F3N5O2.C27H31F3N4O3.C26H30F3N5O3/c1-16(37)35-9-7-20(8-10-35)40-24-14-22-17(15-36(34-22)19-12-18(13-19)27(2,3)39)11-23(24)33-26(38)21-5-4-6-25(32-21)28(29,30)31;1-27(2,3)18-13-19(14-18)36-16-17-12-23(33-26(37)21-6-5-7-25(32-21)28(29,30)31)24(15-22(17)34-36)38-20-8-10-35(4)11-9-20;1-26(2,3)17-12-18(13-17)34-15-16-11-22(23(14-21(16)33-34)37-19-7-9-36-10-8-19)32-25(35)20-5-4-6-24(31-20)27(28,29)30;1-25(2,36)16-11-17(12-16)34-14-15-10-21(22(13-20(15)33-34)37-18-6-8-30-9-7-18)32-24(35)19-4-3-5-23(31-19)26(27,28)29/h4-6,11,14-15,18-20,39H,7-10,12-13H2,1-3H3,(H,33,38);5-7,12,15-16,18-20H,8-11,13-14H2,1-4H3,(H,33,37);4-6,11,14-15,17-19H,7-10,12-13H2,1-3H3,(H,32,35);3-5,10,13-14,16-18,30,36H,6-9,11-12H2,1-2H3,(H,32,35)
InChIKeyAYLPSQURWSNIND-UHFFFAOYSA-N
XLogP21.80
TPSA361.43 Ų
H-Bond Donors7
H-Bond Acceptors26
Rotatable Bonds22
Heavy Atoms152
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002123.31
LogP ≤ 521.80
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1026

Analyze N-[6-(1-acetylpiperidin-4-yl)oxy-2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(1-methylpiperidin-4-yl)oxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(oxan-4-yloxy)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-piperidin-4-yloxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide with MolForge

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Related Compounds

US9951086, Example 220
CID 118172527
US9951086, Example 6
CID 118172711
US9951086, Example 70
CID 118172743
US9951086, Example 261
CID 118172784
US9951086, Example 300
CID 118172826
US9951086, Example 67
CID 118173073
US9951086, Example 44
CID 118173108
US9951086, Example 48
CID 118173176
US9951086, Example 50
CID 118182231
US9951086, Example 51
CID 118182536
US9951086, Example 52
CID 118182538
US11065231, Example 61
CID 138656826

Frequently Asked Questions

What is the IUPAC name of N-[6-(1-acetylpiperidin-4-yl)oxy-2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(1-methylpiperidin-4-yl)oxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(oxan-4-yloxy)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-piperidin-4-yloxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide?
The IUPAC name of N-[6-(1-acetylpiperidin-4-yl)oxy-2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(1-methylpiperidin-4-yl)oxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(oxan-4-yloxy)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-piperidin-4-yloxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide (CID 164954252) is N-[6-(1-acetylpiperidin-4-yl)oxy-2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(1-methylpiperidin-4-yl)oxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(oxan-4-yloxy)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-piperidin-4-yloxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide.
What is the SMILES notation for N-[6-(1-acetylpiperidin-4-yl)oxy-2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(1-methylpiperidin-4-yl)oxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(oxan-4-yloxy)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-piperidin-4-yloxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide?
The canonical SMILES for N-[6-(1-acetylpiperidin-4-yl)oxy-2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(1-methylpiperidin-4-yl)oxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(oxan-4-yloxy)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-piperidin-4-yloxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide is CC(=O)N1CCC(Oc2cc3nn(C4CC(C(C)(C)O)C4)cc3cc2NC(=O)c2cccc(C(F)(F)F)n2)CC1.CC(C)(C)C1CC(n2cc3cc(NC(=O)c4cccc(C(F)(F)F)n4)c(OC4CCOCC4)cc3n2)C1.CC(C)(O)C1CC(n2cc3cc(NC(=O)c4cccc(C(F)(F)F)n4)c(OC4CCNCC4)cc3n2)C1.CN1CCC(Oc2cc3nn(C4CC(C(C)(C)C)C4)cc3cc2NC(=O)c2cccc(C(F)(F)F)n2)CC1.
What is the InChIKey of N-[6-(1-acetylpiperidin-4-yl)oxy-2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(1-methylpiperidin-4-yl)oxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(oxan-4-yloxy)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-piperidin-4-yloxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide?
The InChIKey is AYLPSQURWSNIND-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H32F3N5O4.C28H34F3N5O2.C27H31F3N4O3.C26H30F3N5O3/c1-16(37)35-9-7-20(8-10-35)40-24-14-22-17(15-36(34-22)19-12-18(13-19)27(2,3)39)11-23(24)33-26(38)21-5-4-6-25(32-21)28(29,30)31;1-27(2,3)18-13-19(14-18)36-16-17-12-23(33-26(37)21-6-5-7-25(32-21)28(29,30)31)24(15-22(17)34-36)38-20-8-10-35(4)11-9-20;1-26(2,3)17-12-18(13-17)34-15-16-11-22(23(14-21(16)33-34)37-19-7-9-36-10-8-19)32-25(35)20-5-4-6-24(31-20)27(28,29)30;1-25(2,36)16-11-17(12-16)34-14-15-10-21(22(13-20(15)33-34)37-18-6-8-30-9-7-18)32-24(35)19-4-3-5-23(31-19)26(27,28)29/h4-6,11,14-15,18-20,39H,7-10,12-13H2,1-3H3,(H,33,38);5-7,12,15-16,18-20H,8-11,13-14H2,1-4H3,(H,33,37);4-6,11,14-15,17-19H,7-10,12-13H2,1-3H3,(H,32,35);3-5,10,13-14,16-18,30,36H,6-9,11-12H2,1-2H3,(H,32,35).
What are the key properties of N-[6-(1-acetylpiperidin-4-yl)oxy-2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(1-methylpiperidin-4-yl)oxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(oxan-4-yloxy)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-piperidin-4-yloxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide?
N-[6-(1-acetylpiperidin-4-yl)oxy-2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(1-methylpiperidin-4-yl)oxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(oxan-4-yloxy)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-piperidin-4-yloxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide has a molecular weight of 2123.31 g/mol, XLogP of 21.80, 22 rotatable bonds, 7 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(1-acetylpiperidin-4-yl)oxy-2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(1-methylpiperidin-4-yl)oxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-tert-butylcyclobutyl)-6-(oxan-4-yloxy)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-piperidin-4-yloxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide is sourced from PubChem (CID 164954252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).