5-N-[(2S)-1-amino-1-oxopropan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(1S)-2-hydroxy-1-phenylethyl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-(methanesulfonamido)-N-phenyl-1H-indazole-3-carboxamide;N-phenyl-5-[(2-thiophen-2-ylacetyl)amino]-1H-indazole-3-carboxamide

C96H89N21O14S2 — CID 162028241

IUPAC5-N-[(2S)-1-amino-1-oxopropan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(1S)-2-hydroxy-1-phenylethyl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-(methanesulfonamido)-N-phenyl-1H-indazole-3-carboxamide;N-phenyl-5-[(2-thiophen-2-ylacetyl)amino]-1H-indazole-3-carboxamide
SMILESCC(C)[C@@H](CO)NC(=O)c1ccc2[nH]nc(C(=O)Nc3ccccc3)c2c1.CS(=O)(=O)Nc1ccc2[nH]nc(C(=O)Nc3ccccc3)c2c1.C[C@H](NC(=O)c1ccc2[nH]nc(C(=O)Nc3ccccc3)c2c1)C(N)=O.O=C(Cc1cccs1)Nc1ccc2[nH]nc(C(=O)Nc3ccccc3)c2c1.O=C(N[C@H](CO)c1ccccc1)c1ccc2[nH]nc(C(=O)Nc3ccccc3)c2c1
InChIInChI=1S/C23H20N4O3.C20H22N4O3.C20H16N4O2S.C18H17N5O3.C15H14N4O3S/c28-14-20(15-7-3-1-4-8-15)25-22(29)16-11-12-19-18(13-16)21(27-26-19)23(30)24-17-9-5-2-6-10-17;1-12(2)17(11-25)22-19(26)13-8-9-16-15(10-13)18(24-23-16)20(27)21-14-6-4-3-5-7-14;25-18(12-15-7-4-10-27-15)21-14-8-9-17-16(11-14)19(24-23-17)20(26)22-13-5-2-1-3-6-13;1-10(16(19)24)20-17(25)11-7-8-14-13(9-11)15(23-22-14)18(26)21-12-5-3-2-4-6-12;1-23(21,22)19-11-7-8-13-12(9-11)14(18-17-13)15(20)16-10-5-3-2-4-6-10/h1-13,20,28H,14H2,(H,24,30)(H,25,29)(H,26,27);3-10,12,17,25H,11H2,1-2H3,(H,21,27)(H,22,26)(H,23,24);1-11H,12H2,(H,21,25)(H,22,26)(H,23,24);2-10H,1H3,(H2,19,24)(H,20,25)(H,21,26)(H,22,23);2-9,19H,1H3,(H,16,20)(H,17,18)/t20-;17-;;10-;/m11.0./s1
InChIKeyYVRBVJFJAXBGQZ-VZILJERBSA-N
MW1825.03 g/mol
LogP13.50
Rot. Bonds26

About 5-N-[(2S)-1-amino-1-oxopropan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(1S)-2-hydroxy-1-phenylethyl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-(methanesulfonamido)-N-phenyl-1H-indazole-3-carboxamide;N-phenyl-5-[(2-thiophen-2-ylacetyl)amino]-1H-indazole-3-carboxamide

5-N-[(2S)-1-amino-1-oxopropan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(1S)-2-hydroxy-1-phenylethyl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-(methanesulfonamido)-N-phenyl-1H-indazole-3-carboxamide;N-phenyl-5-[(2-thiophen-2-ylacetyl)amino]-1H-indazole-3-carboxamide (PubChem CID 162028241) has the molecular formula C96H89N21O14S2 and a molecular weight of 1825.03 g/mol. Its IUPAC name is 5-N-[(2S)-1-amino-1-oxopropan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(1S)-2-hydroxy-1-phenylethyl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-(methanesulfonamido)-N-phenyl-1H-indazole-3-carboxamide;N-phenyl-5-[(2-thiophen-2-ylacetyl)amino]-1H-indazole-3-carboxamide.

Molecular Properties

Compound Name5-N-[(2S)-1-amino-1-oxopropan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(1S)-2-hydroxy-1-phenylethyl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-(methanesulfonamido)-N-phenyl-1H-indazole-3-carboxamide;N-phenyl-5-[(2-thiophen-2-ylacetyl)amino]-1H-indazole-3-carboxamide
PubChem CID162028241
Molecular FormulaC96H89N21O14S2
Molecular Weight1825.03 g/mol
Exact Mass1823.63
IUPAC Name5-N-[(2S)-1-amino-1-oxopropan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(1S)-2-hydroxy-1-phenylethyl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-(methanesulfonamido)-N-phenyl-1H-indazole-3-carboxamide;N-phenyl-5-[(2-thiophen-2-ylacetyl)amino]-1H-indazole-3-carboxamide
SMILESCC(C)[C@@H](CO)NC(=O)c1ccc2[nH]nc(C(=O)Nc3ccccc3)c2c1.CS(=O)(=O)Nc1ccc2[nH]nc(C(=O)Nc3ccccc3)c2c1.C[C@H](NC(=O)c1ccc2[nH]nc(C(=O)Nc3ccccc3)c2c1)C(N)=O.O=C(Cc1cccs1)Nc1ccc2[nH]nc(C(=O)Nc3ccccc3)c2c1.O=C(N[C@H](CO)c1ccccc1)c1ccc2[nH]nc(C(=O)Nc3ccccc3)c2c1
InChIInChI=1S/C23H20N4O3.C20H22N4O3.C20H16N4O2S.C18H17N5O3.C15H14N4O3S/c28-14-20(15-7-3-1-4-8-15)25-22(29)16-11-12-19-18(13-16)21(27-26-19)23(30)24-17-9-5-2-6-10-17;1-12(2)17(11-25)22-19(26)13-8-9-16-15(10-13)18(24-23-16)20(27)21-14-6-4-3-5-7-14;25-18(12-15-7-4-10-27-15)21-14-8-9-17-16(11-14)19(24-23-17)20(26)22-13-5-2-1-3-6-13;1-10(16(19)24)20-17(25)11-7-8-14-13(9-11)15(23-22-14)18(26)21-12-5-3-2-4-6-12;1-23(21,22)19-11-7-8-13-12(9-11)14(18-17-13)15(20)16-10-5-3-2-4-6-10/h1-13,20,28H,14H2,(H,24,30)(H,25,29)(H,26,27);3-10,12,17,25H,11H2,1-2H3,(H,21,27)(H,22,26)(H,23,24);1-11H,12H2,(H,21,25)(H,22,26)(H,23,24);2-10H,1H3,(H2,19,24)(H,20,25)(H,21,26)(H,22,23);2-9,19H,1H3,(H,16,20)(H,17,18)/t20-;17-;;10-;/m11.0./s1
InChIKeyYVRBVJFJAXBGQZ-VZILJERBSA-N
XLogP13.50
TPSA535.02 Ų
H-Bond Donors18
H-Bond Acceptors20
Rotatable Bonds26
Heavy Atoms133
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001825.03
LogP ≤ 513.50
H-Bond Donors ≤ 518
H-Bond Acceptors ≤ 1020

Analyze 5-N-[(2S)-1-amino-1-oxopropan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(1S)-2-hydroxy-1-phenylethyl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-(methanesulfonamido)-N-phenyl-1H-indazole-3-carboxamide;N-phenyl-5-[(2-thiophen-2-ylacetyl)amino]-1H-indazole-3-carboxamide with MolForge

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Related Compounds

N-(2,3-dihydroxypropyl)-3-(3-fluorophenyl)-1H-indazole-5-carboxamide;3-(3-fluorophenyl)-N-[1-(2-fluorophenyl)-2-hydroxyethyl]-1H-indazole-5-carboxamide;N-[3-(3-fluorophenyl)-1H-indazol-5-yl]methanesulfonamide;N-[3-(3-fluorophenyl)-1H-indazol-5-yl]pyridine-3-carboxamide;N-[3-(3-fluorophenyl)-1H-indazol-5-yl]-2-pyridin-4-ylacetamide;N-[3-(3-fluorophenyl)-1H-indazol-5-yl]-2-thiophen-2-ylacetamide;2,2,2-trifluoro-N-[3-(3-fluorophenyl)-1H-indazol-5-yl]ethanesulfonamide
CID 158345857
3-(3-fluorophenyl)-N-[1-(2-fluorophenyl)-2-hydroxyethyl]-1H-indazole-5-carboxamide;N-[3-(3-fluorophenyl)-1H-indazol-5-yl]methanesulfonamide;N-[3-(3-fluorophenyl)-1H-indazol-5-yl]-4-methylbenzenesulfonamide;N-[3-(3-fluorophenyl)-1H-indazol-5-yl]pyridine-3-carboxamide;N-[3-(3-fluorophenyl)-1H-indazol-5-yl]-2-pyridin-4-ylacetamide;N-[3-(3-fluorophenyl)-1H-indazol-5-yl]-2-thiophen-2-ylacetamide;2,2,2-trifluoro-N-[3-(3-fluorophenyl)-1H-indazol-5-yl]ethanesulfonamide
CID 159364491
5-(furan-2-carbonylamino)-N-phenyl-1H-indazole-3-carboxamide;5-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-(methanesulfonamido)-N-phenyl-1H-indazole-3-carboxamide;N-phenyl-5-[(2-thiophen-2-ylacetyl)amino]-1H-indazole-3-carboxamide
CID 157737869
N-[(2S)-1-amino-1-oxopropan-2-yl]-4-fluoro-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-indazole-5-carboxamide;4-fluoro-3-[(E)-2-(3-fluorophenyl)ethenyl]-N-[(2S)-1-(2-methoxyethylamino)-1-oxopropan-2-yl]-1H-indazole-5-carboxamide;4-fluoro-3-[(E)-2-(3-fluorophenyl)ethenyl]-1-methylindazol-5-amine;4-fluoro-3-[(E)-2-(3-fluorophenyl)ethenyl]-1-methylindazole-5-carboxylic acid;N-[4-fluoro-3-[(E)-2-(3-fluorophenyl)ethenyl]-1-methylindazol-5-yl]-2-thiophen-2-ylacetamide;4-fluoro-3-iodo-2H-indazole-5-carbonitrile
CID 158174867
N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]acetamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-2,2-dimethylpropanamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-3-hydroxy-2-phenylpropanamide;[6-fluoro-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-indazol-5-yl]methanamine;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-2-thiophen-2-ylacetamide
CID 159032038
N-(2,3-dihydroxypropyl)-3-(3-fluorophenyl)-1H-indazole-5-carboxamide;3-(3-fluorophenyl)-N-[1-(2-fluorophenyl)-2-hydroxyethyl]-1H-indazole-5-carboxamide;N-[3-(3-fluorophenyl)-1H-indazol-5-yl]methanesulfonamide;N-[3-(3-fluorophenyl)-1H-indazol-5-yl]pyridine-3-carboxamide;N-[3-(3-fluorophenyl)-1H-indazol-5-yl]-2-pyridin-4-ylacetamide;N-[3-(3-fluorophenyl)-1H-indazol-5-yl]-2-thiophen-2-ylacetamide
CID 160074349
N-[(2S)-1-amino-1-oxopropan-2-yl]-4-fluoro-3-(3-fluorophenyl)-1H-indazole-5-carboxamide;N-[(2S)-1-amino-1-oxopropan-2-yl]-3-(3-fluorophenyl)-6-methyl-1H-indazole-5-carboxamide;N-(cyclopropylmethyl)-3-(3-fluorophenyl)-6-methyl-1H-indazole-5-carboxamide;4-fluoro-3-(3-fluorophenyl)-N-(2-methylsulfanylethyl)-1H-indazole-5-carboxamide;3-(3-fluorophenyl)-N-[(1S)-2-hydroxy-1-phenylethyl]-6-methyl-1H-indazole-5-carboxamide;3-(3-fluorophenyl)-6-methyl-N-(2-methylsulfanylethyl)-1H-indazole-5-carboxamide
CID 161125260
N-(2-acetamidoethyl)-3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazole-5-carboxamide;N-[(2S)-1-amino-1-oxopropan-2-yl]-3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazole-5-carboxamide;3-(1-benzothiophen-2-yl)-4-fluoro-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-1H-indazole-5-carboxamide;3-(1-benzothiophen-2-yl)-4-fluoro-N-(2-thiophen-2-ylethyl)-1H-indazole-5-carboxamide;N-cyclopropyl-4-fluoro-3-naphthalen-2-yl-1H-indazole-5-carboxamide
CID 161803344

Frequently Asked Questions

What is the IUPAC name of 5-N-[(2S)-1-amino-1-oxopropan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(1S)-2-hydroxy-1-phenylethyl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-(methanesulfonamido)-N-phenyl-1H-indazole-3-carboxamide;N-phenyl-5-[(2-thiophen-2-ylacetyl)amino]-1H-indazole-3-carboxamide?
The IUPAC name of 5-N-[(2S)-1-amino-1-oxopropan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(1S)-2-hydroxy-1-phenylethyl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-(methanesulfonamido)-N-phenyl-1H-indazole-3-carboxamide;N-phenyl-5-[(2-thiophen-2-ylacetyl)amino]-1H-indazole-3-carboxamide (CID 162028241) is 5-N-[(2S)-1-amino-1-oxopropan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(1S)-2-hydroxy-1-phenylethyl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-(methanesulfonamido)-N-phenyl-1H-indazole-3-carboxamide;N-phenyl-5-[(2-thiophen-2-ylacetyl)amino]-1H-indazole-3-carboxamide.
What is the SMILES notation for 5-N-[(2S)-1-amino-1-oxopropan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(1S)-2-hydroxy-1-phenylethyl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-(methanesulfonamido)-N-phenyl-1H-indazole-3-carboxamide;N-phenyl-5-[(2-thiophen-2-ylacetyl)amino]-1H-indazole-3-carboxamide?
The canonical SMILES for 5-N-[(2S)-1-amino-1-oxopropan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(1S)-2-hydroxy-1-phenylethyl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-(methanesulfonamido)-N-phenyl-1H-indazole-3-carboxamide;N-phenyl-5-[(2-thiophen-2-ylacetyl)amino]-1H-indazole-3-carboxamide is CC(C)[C@@H](CO)NC(=O)c1ccc2[nH]nc(C(=O)Nc3ccccc3)c2c1.CS(=O)(=O)Nc1ccc2[nH]nc(C(=O)Nc3ccccc3)c2c1.C[C@H](NC(=O)c1ccc2[nH]nc(C(=O)Nc3ccccc3)c2c1)C(N)=O.O=C(Cc1cccs1)Nc1ccc2[nH]nc(C(=O)Nc3ccccc3)c2c1.O=C(N[C@H](CO)c1ccccc1)c1ccc2[nH]nc(C(=O)Nc3ccccc3)c2c1.
What is the InChIKey of 5-N-[(2S)-1-amino-1-oxopropan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(1S)-2-hydroxy-1-phenylethyl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-(methanesulfonamido)-N-phenyl-1H-indazole-3-carboxamide;N-phenyl-5-[(2-thiophen-2-ylacetyl)amino]-1H-indazole-3-carboxamide?
The InChIKey is YVRBVJFJAXBGQZ-VZILJERBSA-N. The full InChI is InChI=1S/C23H20N4O3.C20H22N4O3.C20H16N4O2S.C18H17N5O3.C15H14N4O3S/c28-14-20(15-7-3-1-4-8-15)25-22(29)16-11-12-19-18(13-16)21(27-26-19)23(30)24-17-9-5-2-6-10-17;1-12(2)17(11-25)22-19(26)13-8-9-16-15(10-13)18(24-23-16)20(27)21-14-6-4-3-5-7-14;25-18(12-15-7-4-10-27-15)21-14-8-9-17-16(11-14)19(24-23-17)20(26)22-13-5-2-1-3-6-13;1-10(16(19)24)20-17(25)11-7-8-14-13(9-11)15(23-22-14)18(26)21-12-5-3-2-4-6-12;1-23(21,22)19-11-7-8-13-12(9-11)14(18-17-13)15(20)16-10-5-3-2-4-6-10/h1-13,20,28H,14H2,(H,24,30)(H,25,29)(H,26,27);3-10,12,17,25H,11H2,1-2H3,(H,21,27)(H,22,26)(H,23,24);1-11H,12H2,(H,21,25)(H,22,26)(H,23,24);2-10H,1H3,(H2,19,24)(H,20,25)(H,21,26)(H,22,23);2-9,19H,1H3,(H,16,20)(H,17,18)/t20-;17-;;10-;/m11.0./s1.
What are the key properties of 5-N-[(2S)-1-amino-1-oxopropan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(1S)-2-hydroxy-1-phenylethyl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-(methanesulfonamido)-N-phenyl-1H-indazole-3-carboxamide;N-phenyl-5-[(2-thiophen-2-ylacetyl)amino]-1H-indazole-3-carboxamide?
5-N-[(2S)-1-amino-1-oxopropan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(1S)-2-hydroxy-1-phenylethyl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-(methanesulfonamido)-N-phenyl-1H-indazole-3-carboxamide;N-phenyl-5-[(2-thiophen-2-ylacetyl)amino]-1H-indazole-3-carboxamide has a molecular weight of 1825.03 g/mol, XLogP of 13.50, 26 rotatable bonds, 18 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-[(2S)-1-amino-1-oxopropan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-N-[(1S)-2-hydroxy-1-phenylethyl]-3-N-phenyl-1H-indazole-3,5-dicarboxamide;5-(methanesulfonamido)-N-phenyl-1H-indazole-3-carboxamide;N-phenyl-5-[(2-thiophen-2-ylacetyl)amino]-1H-indazole-3-carboxamide is sourced from PubChem (CID 162028241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).