N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-pyrazol-1-ylindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;2-(3-methylcyclobutyl)propan-2-ol;N-(6-pyrazol-1-yl-1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2-carboxamide

C49H50F6N12O4 — CID 165017193

IUPACN-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-pyrazol-1-ylindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;2-(3-methylcyclobutyl)propan-2-ol;N-(6-pyrazol-1-yl-1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2-carboxamide
SMILESCC(C)(O)C1CC(n2cc3cc(NC(=O)c4cccc(C(F)(F)F)n4)c(-n4cccn4)cc3n2)C1.CC1CC(C(C)(C)O)C1.O=C(Nc1cc2cn[nH]c2cc1-n1cccn1)c1cccc(C(F)(F)F)n1
InChIInChI=1S/C24H23F3N6O2.C17H11F3N6O.C8H16O/c1-23(2,35)15-10-16(11-15)33-13-14-9-19(20(12-18(14)31-33)32-8-4-7-28-32)30-22(34)17-5-3-6-21(29-17)24(25,26)27;18-17(19,20)15-4-1-3-11(23-15)16(27)24-13-7-10-9-21-25-12(10)8-14(13)26-6-2-5-22-26;1-6-4-7(5-6)8(2,3)9/h3-9,12-13,15-16,35H,10-11H2,1-2H3,(H,30,34);1-9H,(H,21,25)(H,24,27);6-7,9H,4-5H2,1-3H3
InChIKeyKPLPIDZNKXXXQM-UHFFFAOYSA-N
MW985.01 g/mol
LogP9.83
Rot. Bonds9

About N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-pyrazol-1-ylindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;2-(3-methylcyclobutyl)propan-2-ol;N-(6-pyrazol-1-yl-1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2-carboxamide

N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-pyrazol-1-ylindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;2-(3-methylcyclobutyl)propan-2-ol;N-(6-pyrazol-1-yl-1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2-carboxamide (PubChem CID 165017193) has the molecular formula C49H50F6N12O4 and a molecular weight of 985.01 g/mol. Its IUPAC name is N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-pyrazol-1-ylindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;2-(3-methylcyclobutyl)propan-2-ol;N-(6-pyrazol-1-yl-1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-pyrazol-1-ylindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;2-(3-methylcyclobutyl)propan-2-ol;N-(6-pyrazol-1-yl-1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2-carboxamide
PubChem CID165017193
Molecular FormulaC49H50F6N12O4
Molecular Weight985.01 g/mol
Exact Mass984.40
IUPAC NameN-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-pyrazol-1-ylindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;2-(3-methylcyclobutyl)propan-2-ol;N-(6-pyrazol-1-yl-1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2-carboxamide
SMILESCC(C)(O)C1CC(n2cc3cc(NC(=O)c4cccc(C(F)(F)F)n4)c(-n4cccn4)cc3n2)C1.CC1CC(C(C)(C)O)C1.O=C(Nc1cc2cn[nH]c2cc1-n1cccn1)c1cccc(C(F)(F)F)n1
InChIInChI=1S/C24H23F3N6O2.C17H11F3N6O.C8H16O/c1-23(2,35)15-10-16(11-15)33-13-14-9-19(20(12-18(14)31-33)32-8-4-7-28-32)30-22(34)17-5-3-6-21(29-17)24(25,26)27;18-17(19,20)15-4-1-3-11(23-15)16(27)24-13-7-10-9-21-25-12(10)8-14(13)26-6-2-5-22-26;1-6-4-7(5-6)8(2,3)9/h3-9,12-13,15-16,35H,10-11H2,1-2H3,(H,30,34);1-9H,(H,21,25)(H,24,27);6-7,9H,4-5H2,1-3H3
InChIKeyKPLPIDZNKXXXQM-UHFFFAOYSA-N
XLogP9.83
TPSA206.58 Ų
H-Bond Donors5
H-Bond Acceptors13
Rotatable Bonds9
Heavy Atoms71
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500985.01
LogP ≤ 59.83
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1013

Analyze N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-pyrazol-1-ylindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;2-(3-methylcyclobutyl)propan-2-ol;N-(6-pyrazol-1-yl-1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2-carboxamide with MolForge

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Related Compounds

N-[2-(3-hydroxy-3-methylbutyl)-6-pyrazol-1-ylindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 153524683
N-[6-(dimethylamino)-2-(4-hydroxy-4-methylcyclohexyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 154970245
N-[6-(dimethylamino)-2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-fluoropyridine-2-carboxamide
CID 154970246
N-[6-(dimethylamino)-2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 154970309
N-[2-(4-hydroxy-4-methylcyclohexyl)-6-pyrazol-1-ylindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 154970316
N-[6-fluoro-2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 154970409
N-[6-(4-hydroxypiperidin-1-yl)-2-(4-propan-2-ylcyclohexyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 155448666
N-[6-[4-(hydroxymethyl)piperidin-1-yl]-2-(4-methylcyclohexyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 155448908
N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-(methylamino)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 163676576
N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-pyrazol-1-ylindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 164801976
N-[6-(4-cyanopyrazol-1-yl)-2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 164801977
N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-pyridin-2-ylindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 164801986

Frequently Asked Questions

What is the IUPAC name of N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-pyrazol-1-ylindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;2-(3-methylcyclobutyl)propan-2-ol;N-(6-pyrazol-1-yl-1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2-carboxamide?
The IUPAC name of N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-pyrazol-1-ylindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;2-(3-methylcyclobutyl)propan-2-ol;N-(6-pyrazol-1-yl-1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2-carboxamide (CID 165017193) is N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-pyrazol-1-ylindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;2-(3-methylcyclobutyl)propan-2-ol;N-(6-pyrazol-1-yl-1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2-carboxamide.
What is the SMILES notation for N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-pyrazol-1-ylindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;2-(3-methylcyclobutyl)propan-2-ol;N-(6-pyrazol-1-yl-1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2-carboxamide?
The canonical SMILES for N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-pyrazol-1-ylindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;2-(3-methylcyclobutyl)propan-2-ol;N-(6-pyrazol-1-yl-1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2-carboxamide is CC(C)(O)C1CC(n2cc3cc(NC(=O)c4cccc(C(F)(F)F)n4)c(-n4cccn4)cc3n2)C1.CC1CC(C(C)(C)O)C1.O=C(Nc1cc2cn[nH]c2cc1-n1cccn1)c1cccc(C(F)(F)F)n1.
What is the InChIKey of N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-pyrazol-1-ylindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;2-(3-methylcyclobutyl)propan-2-ol;N-(6-pyrazol-1-yl-1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2-carboxamide?
The InChIKey is KPLPIDZNKXXXQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23F3N6O2.C17H11F3N6O.C8H16O/c1-23(2,35)15-10-16(11-15)33-13-14-9-19(20(12-18(14)31-33)32-8-4-7-28-32)30-22(34)17-5-3-6-21(29-17)24(25,26)27;18-17(19,20)15-4-1-3-11(23-15)16(27)24-13-7-10-9-21-25-12(10)8-14(13)26-6-2-5-22-26;1-6-4-7(5-6)8(2,3)9/h3-9,12-13,15-16,35H,10-11H2,1-2H3,(H,30,34);1-9H,(H,21,25)(H,24,27);6-7,9H,4-5H2,1-3H3.
What are the key properties of N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-pyrazol-1-ylindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;2-(3-methylcyclobutyl)propan-2-ol;N-(6-pyrazol-1-yl-1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2-carboxamide?
N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-pyrazol-1-ylindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;2-(3-methylcyclobutyl)propan-2-ol;N-(6-pyrazol-1-yl-1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2-carboxamide has a molecular weight of 985.01 g/mol, XLogP of 9.83, 9 rotatable bonds, 5 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]-6-pyrazol-1-ylindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;2-(3-methylcyclobutyl)propan-2-ol;N-(6-pyrazol-1-yl-1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2-carboxamide is sourced from PubChem (CID 165017193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).