5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide

C112H116F8N28O4 — CID 159703481

IUPAC5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide
SMILESCC1(F)CCN(c2ccc(NC(=O)c3n[nH]c4ccc(-c5cncc(CN6CCC(F)(F)C6)c5)cc34)cn2)C1.CC1(F)CCN(c2ccc(NC(=O)c3n[nH]c4ccc(-c5cncc(CN6CCC(F)(F)CC6)c5)cc34)cn2)C1.CC1(F)CCN(c2ccc(NC(=O)c3n[nH]c4ccc(-c5cncc(N6CCCC6)c5)cc34)cn2)C1.CC1(F)CCN(c2ccc(NC(=O)c3n[nH]c4ccc(-c5cncc(N6CCCCC6)c5)cc34)cn2)C1
InChIInChI=1S/C29H30F3N7O.C28H28F3N7O.C28H30FN7O.C27H28FN7O/c1-28(30)6-11-39(18-28)25-5-3-22(16-34-25)35-27(40)26-23-13-20(2-4-24(23)36-37-26)21-12-19(14-33-15-21)17-38-9-7-29(31,32)8-10-38;1-27(29)6-9-38(16-27)24-5-3-21(14-33-24)34-26(39)25-22-11-19(2-4-23(22)35-36-25)20-10-18(12-32-13-20)15-37-8-7-28(30,31)17-37;1-28(29)9-12-36(18-28)25-8-6-21(16-31-25)32-27(37)26-23-14-19(5-7-24(23)33-34-26)20-13-22(17-30-15-20)35-10-3-2-4-11-35;1-27(28)8-11-35(17-27)24-7-5-20(15-30-24)31-26(36)25-22-13-18(4-6-23(22)32-33-25)19-12-21(16-29-14-19)34-9-2-3-10-34/h2-5,12-16H,6-11,17-18H2,1H3,(H,35,40)(H,36,37);2-5,10-14H,6-9,15-17H2,1H3,(H,34,39)(H,35,36);5-8,13-17H,2-4,9-12,18H2,1H3,(H,32,37)(H,33,34);4-7,12-16H,2-3,8-11,17H2,1H3,(H,31,36)(H,32,33)
InChIKeyMXXMEJNSLKNFCV-UHFFFAOYSA-N
MW2070.34 g/mol
LogP20.50
Rot. Bonds22

About 5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-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-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide (PubChem CID 159703481) has the molecular formula C112H116F8N28O4 and a molecular weight of 2070.34 g/mol. Its IUPAC name is 5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-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-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide
PubChem CID159703481
Molecular FormulaC112H116F8N28O4
Molecular Weight2070.34 g/mol
Exact Mass2068.96
IUPAC Name5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide
SMILESCC1(F)CCN(c2ccc(NC(=O)c3n[nH]c4ccc(-c5cncc(CN6CCC(F)(F)C6)c5)cc34)cn2)C1.CC1(F)CCN(c2ccc(NC(=O)c3n[nH]c4ccc(-c5cncc(CN6CCC(F)(F)CC6)c5)cc34)cn2)C1.CC1(F)CCN(c2ccc(NC(=O)c3n[nH]c4ccc(-c5cncc(N6CCCC6)c5)cc34)cn2)C1.CC1(F)CCN(c2ccc(NC(=O)c3n[nH]c4ccc(-c5cncc(N6CCCCC6)c5)cc34)cn2)C1
InChIInChI=1S/C29H30F3N7O.C28H28F3N7O.C28H30FN7O.C27H28FN7O/c1-28(30)6-11-39(18-28)25-5-3-22(16-34-25)35-27(40)26-23-13-20(2-4-24(23)36-37-26)21-12-19(14-33-15-21)17-38-9-7-29(31,32)8-10-38;1-27(29)6-9-38(16-27)24-5-3-21(14-33-24)34-26(39)25-22-11-19(2-4-23(22)35-36-25)20-10-18(12-32-13-20)15-37-8-7-28(30,31)17-37;1-28(29)9-12-36(18-28)25-8-6-21(16-31-25)32-27(37)26-23-14-19(5-7-24(23)33-34-26)20-13-22(17-30-15-20)35-10-3-2-4-11-35;1-27(28)8-11-35(17-27)24-7-5-20(15-30-24)31-26(36)25-22-13-18(4-6-23(22)32-33-25)19-12-21(16-29-14-19)34-9-2-3-10-34/h2-5,12-16H,6-11,17-18H2,1H3,(H,35,40)(H,36,37);2-5,10-14H,6-9,15-17H2,1H3,(H,34,39)(H,35,36);5-8,13-17H,2-4,9-12,18H2,1H3,(H,32,37)(H,33,34);4-7,12-16H,2-3,8-11,17H2,1H3,(H,31,36)(H,32,33)
InChIKeyMXXMEJNSLKNFCV-UHFFFAOYSA-N
XLogP20.50
TPSA360.16 Ų
H-Bond Donors8
H-Bond Acceptors24
Rotatable Bonds22
Heavy Atoms152
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002070.34
LogP ≤ 520.50
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1024

Analyze 5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-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-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-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-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide (CID 159703481) is 5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-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-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-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-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide is CC1(F)CCN(c2ccc(NC(=O)c3n[nH]c4ccc(-c5cncc(CN6CCC(F)(F)C6)c5)cc34)cn2)C1.CC1(F)CCN(c2ccc(NC(=O)c3n[nH]c4ccc(-c5cncc(CN6CCC(F)(F)CC6)c5)cc34)cn2)C1.CC1(F)CCN(c2ccc(NC(=O)c3n[nH]c4ccc(-c5cncc(N6CCCC6)c5)cc34)cn2)C1.CC1(F)CCN(c2ccc(NC(=O)c3n[nH]c4ccc(-c5cncc(N6CCCCC6)c5)cc34)cn2)C1.
What is the InChIKey of 5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide?
The InChIKey is MXXMEJNSLKNFCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H30F3N7O.C28H28F3N7O.C28H30FN7O.C27H28FN7O/c1-28(30)6-11-39(18-28)25-5-3-22(16-34-25)35-27(40)26-23-13-20(2-4-24(23)36-37-26)21-12-19(14-33-15-21)17-38-9-7-29(31,32)8-10-38;1-27(29)6-9-38(16-27)24-5-3-21(14-33-24)34-26(39)25-22-11-19(2-4-23(22)35-36-25)20-10-18(12-32-13-20)15-37-8-7-28(30,31)17-37;1-28(29)9-12-36(18-28)25-8-6-21(16-31-25)32-27(37)26-23-14-19(5-7-24(23)33-34-26)20-13-22(17-30-15-20)35-10-3-2-4-11-35;1-27(28)8-11-35(17-27)24-7-5-20(15-30-24)31-26(36)25-22-13-18(4-6-23(22)32-33-25)19-12-21(16-29-14-19)34-9-2-3-10-34/h2-5,12-16H,6-11,17-18H2,1H3,(H,35,40)(H,36,37);2-5,10-14H,6-9,15-17H2,1H3,(H,34,39)(H,35,36);5-8,13-17H,2-4,9-12,18H2,1H3,(H,32,37)(H,33,34);4-7,12-16H,2-3,8-11,17H2,1H3,(H,31,36)(H,32,33).
What are the key properties of 5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-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-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide has a molecular weight of 2070.34 g/mol, XLogP of 20.50, 22 rotatable bonds, 8 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(3-fluoro-3-methylpyrrolidin-1-yl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide is sourced from PubChem (CID 159703481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).