5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(2-fluorophenyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide

C115H96F6N24O5 — CID 158260178

IUPAC5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(2-fluorophenyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide
SMILESO=C(Nc1ccc(-c2ccccc2F)nc1)c1n[nH]c2ccc(-c3cncc(CN4CCC(F)(F)CC4)c3)cc12.O=C(Nc1ccc(-c2ccccc2F)nc1)c1n[nH]c2ccc(-c3cncc(N4CCCC4)c3)cc12.O=C(Nc1ccc(-c2ccccc2F)nc1)c1n[nH]c2ccc(-c3cncc(N4CCCCC4)c3)cc12.O=C(Nc1ccc(-c2ccccc2F)nc1)c1n[nH]c2ccc(-c3cncc(N4CCOCC4)c3)cc12
InChIInChI=1S/C30H25F3N6O.C29H25FN6O.C28H23FN6O2.C28H23FN6O/c31-25-4-2-1-3-23(25)26-8-6-22(17-35-26)36-29(40)28-24-14-20(5-7-27(24)37-38-28)21-13-19(15-34-16-21)18-39-11-9-30(32,33)10-12-39;30-25-7-3-2-6-23(25)26-11-9-21(17-32-26)33-29(37)28-24-15-19(8-10-27(24)34-35-28)20-14-22(18-31-16-20)36-12-4-1-5-13-36;29-24-4-2-1-3-22(24)25-8-6-20(16-31-25)32-28(36)27-23-14-18(5-7-26(23)33-34-27)19-13-21(17-30-15-19)35-9-11-37-12-10-35;29-24-6-2-1-5-22(24)25-10-8-20(16-31-25)32-28(36)27-23-14-18(7-9-26(23)33-34-27)19-13-21(17-30-15-19)35-11-3-4-12-35/h1-8,13-17H,9-12,18H2,(H,36,40)(H,37,38);2-3,6-11,14-18H,1,4-5,12-13H2,(H,33,37)(H,34,35);1-8,13-17H,9-12H2,(H,32,36)(H,33,34);1-2,5-10,13-17H,3-4,11-12H2,(H,32,36)(H,33,34)
InChIKeyGHTYZDQLBIARNQ-UHFFFAOYSA-N
MW2008.18 g/mol
LogP22.97
Rot. Bonds21

About 5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(2-fluorophenyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide

5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(2-fluorophenyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide (PubChem CID 158260178) has the molecular formula C115H96F6N24O5 and a molecular weight of 2008.18 g/mol. Its IUPAC name is 5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(2-fluorophenyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide.

Molecular Properties

Compound Name5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(2-fluorophenyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide
PubChem CID158260178
Molecular FormulaC115H96F6N24O5
Molecular Weight2008.18 g/mol
Exact Mass2006.79
IUPAC Name5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(2-fluorophenyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide
SMILESO=C(Nc1ccc(-c2ccccc2F)nc1)c1n[nH]c2ccc(-c3cncc(CN4CCC(F)(F)CC4)c3)cc12.O=C(Nc1ccc(-c2ccccc2F)nc1)c1n[nH]c2ccc(-c3cncc(N4CCCC4)c3)cc12.O=C(Nc1ccc(-c2ccccc2F)nc1)c1n[nH]c2ccc(-c3cncc(N4CCCCC4)c3)cc12.O=C(Nc1ccc(-c2ccccc2F)nc1)c1n[nH]c2ccc(-c3cncc(N4CCOCC4)c3)cc12
InChIInChI=1S/C30H25F3N6O.C29H25FN6O.C28H23FN6O2.C28H23FN6O/c31-25-4-2-1-3-23(25)26-8-6-22(17-35-26)36-29(40)28-24-14-20(5-7-27(24)37-38-28)21-13-19(15-34-16-21)18-39-11-9-30(32,33)10-12-39;30-25-7-3-2-6-23(25)26-11-9-21(17-32-26)33-29(37)28-24-15-19(8-10-27(24)34-35-28)20-14-22(18-31-16-20)36-12-4-1-5-13-36;29-24-4-2-1-3-22(24)25-8-6-20(16-31-25)32-28(36)27-23-14-18(5-7-26(23)33-34-27)19-13-21(17-30-15-19)35-9-11-37-12-10-35;29-24-6-2-1-5-22(24)25-10-8-20(16-31-25)32-28(36)27-23-14-18(7-9-26(23)33-34-27)19-13-21(17-30-15-19)35-11-3-4-12-35/h1-8,13-17H,9-12,18H2,(H,36,40)(H,37,38);2-3,6-11,14-18H,1,4-5,12-13H2,(H,33,37)(H,34,35);1-8,13-17H,9-12H2,(H,32,36)(H,33,34);1-2,5-10,13-17H,3-4,11-12H2,(H,32,36)(H,33,34)
InChIKeyGHTYZDQLBIARNQ-UHFFFAOYSA-N
XLogP22.97
TPSA356.43 Ų
H-Bond Donors8
H-Bond Acceptors21
Rotatable Bonds21
Heavy Atoms150
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002008.18
LogP ≤ 522.97
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1021

Analyze 5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(2-fluorophenyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(2-fluorophenyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide?
The IUPAC name of 5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(2-fluorophenyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide (CID 158260178) is 5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(2-fluorophenyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide.
What is the SMILES notation for 5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(2-fluorophenyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide?
The canonical SMILES for 5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(2-fluorophenyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide is O=C(Nc1ccc(-c2ccccc2F)nc1)c1n[nH]c2ccc(-c3cncc(CN4CCC(F)(F)CC4)c3)cc12.O=C(Nc1ccc(-c2ccccc2F)nc1)c1n[nH]c2ccc(-c3cncc(N4CCCC4)c3)cc12.O=C(Nc1ccc(-c2ccccc2F)nc1)c1n[nH]c2ccc(-c3cncc(N4CCCCC4)c3)cc12.O=C(Nc1ccc(-c2ccccc2F)nc1)c1n[nH]c2ccc(-c3cncc(N4CCOCC4)c3)cc12.
What is the InChIKey of 5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(2-fluorophenyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide?
The InChIKey is GHTYZDQLBIARNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H25F3N6O.C29H25FN6O.C28H23FN6O2.C28H23FN6O/c31-25-4-2-1-3-23(25)26-8-6-22(17-35-26)36-29(40)28-24-14-20(5-7-27(24)37-38-28)21-13-19(15-34-16-21)18-39-11-9-30(32,33)10-12-39;30-25-7-3-2-6-23(25)26-11-9-21(17-32-26)33-29(37)28-24-15-19(8-10-27(24)34-35-28)20-14-22(18-31-16-20)36-12-4-1-5-13-36;29-24-4-2-1-3-22(24)25-8-6-20(16-31-25)32-28(36)27-23-14-18(5-7-26(23)33-34-27)19-13-21(17-30-15-19)35-9-11-37-12-10-35;29-24-6-2-1-5-22(24)25-10-8-20(16-31-25)32-28(36)27-23-14-18(7-9-26(23)33-34-27)19-13-21(17-30-15-19)35-11-3-4-12-35/h1-8,13-17H,9-12,18H2,(H,36,40)(H,37,38);2-3,6-11,14-18H,1,4-5,12-13H2,(H,33,37)(H,34,35);1-8,13-17H,9-12H2,(H,32,36)(H,33,34);1-2,5-10,13-17H,3-4,11-12H2,(H,32,36)(H,33,34).
What are the key properties of 5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(2-fluorophenyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide?
5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(2-fluorophenyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide has a molecular weight of 2008.18 g/mol, XLogP of 22.97, 21 rotatable bonds, 8 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(2-fluorophenyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide is sourced from PubChem (CID 158260178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).