N-cyclopropyl-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(1S)-2-hydroxy-1-phenylethyl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-(2-methylsulfanylethyl)-3-naphthalen-2-yl-2H-indazole-5-carboxamide

C113H94F5N15O7S — CID 158267317

IUPACN-cyclopropyl-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(1S)-2-hydroxy-1-phenylethyl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-(2-methylsulfanylethyl)-3-naphthalen-2-yl-2H-indazole-5-carboxamide
SMILESCC(C)[C@@H](CO)NC(=O)c1cc(F)c2n[nH]c(-c3ccc4ccccc4c3)c2c1.CSCCNC(=O)c1cc(F)c2n[nH]c(-c3ccc4ccccc4c3)c2c1.O=C(NC1CC1)c1cc(F)c2n[nH]c(-c3ccc4ccccc4c3)c2c1.O=C(NCC1CC1)c1cc(F)c2n[nH]c(-c3ccc4ccccc4c3)c2c1.O=C(N[C@H](CO)c1ccccc1)c1cc(F)c2n[nH]c(-c3ccc4ccccc4c3)c2c1
InChIInChI=1S/C26H20FN3O2.C23H22FN3O2.C22H18FN3O.C21H18FN3OS.C21H16FN3O/c27-22-14-20(26(32)28-23(15-31)17-7-2-1-3-8-17)13-21-24(29-30-25(21)22)19-11-10-16-6-4-5-9-18(16)12-19;1-13(2)20(12-28)25-23(29)17-10-18-21(26-27-22(18)19(24)11-17)16-8-7-14-5-3-4-6-15(14)9-16;23-19-11-17(22(27)24-12-13-5-6-13)10-18-20(25-26-21(18)19)16-8-7-14-3-1-2-4-15(14)9-16;1-27-9-8-23-21(26)16-11-17-19(24-25-20(17)18(22)12-16)15-7-6-13-4-2-3-5-14(13)10-15;22-18-11-15(21(26)23-16-7-8-16)10-17-19(24-25-20(17)18)14-6-5-12-3-1-2-4-13(12)9-14/h1-14,23,31H,15H2,(H,28,32)(H,29,30);3-11,13,20,28H,12H2,1-2H3,(H,25,29)(H,26,27);1-4,7-11,13H,5-6,12H2,(H,24,27)(H,25,26);2-7,10-12H,8-9H2,1H3,(H,23,26)(H,24,25);1-6,9-11,16H,7-8H2,(H,23,26)(H,24,25)/t23-;20-;;;/m11.../s1
InChIKeyGIPLOPDLKJWAIY-ZHCXYDCASA-N
MW1901.15 g/mol
LogP22.95
Rot. Bonds22

About N-cyclopropyl-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(1S)-2-hydroxy-1-phenylethyl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-(2-methylsulfanylethyl)-3-naphthalen-2-yl-2H-indazole-5-carboxamide

N-cyclopropyl-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(1S)-2-hydroxy-1-phenylethyl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-(2-methylsulfanylethyl)-3-naphthalen-2-yl-2H-indazole-5-carboxamide (PubChem CID 158267317) has the molecular formula C113H94F5N15O7S and a molecular weight of 1901.15 g/mol. Its IUPAC name is N-cyclopropyl-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(1S)-2-hydroxy-1-phenylethyl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-(2-methylsulfanylethyl)-3-naphthalen-2-yl-2H-indazole-5-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(1S)-2-hydroxy-1-phenylethyl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-(2-methylsulfanylethyl)-3-naphthalen-2-yl-2H-indazole-5-carboxamide
PubChem CID158267317
Molecular FormulaC113H94F5N15O7S
Molecular Weight1901.15 g/mol
Exact Mass1899.71
IUPAC NameN-cyclopropyl-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(1S)-2-hydroxy-1-phenylethyl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-(2-methylsulfanylethyl)-3-naphthalen-2-yl-2H-indazole-5-carboxamide
SMILESCC(C)[C@@H](CO)NC(=O)c1cc(F)c2n[nH]c(-c3ccc4ccccc4c3)c2c1.CSCCNC(=O)c1cc(F)c2n[nH]c(-c3ccc4ccccc4c3)c2c1.O=C(NC1CC1)c1cc(F)c2n[nH]c(-c3ccc4ccccc4c3)c2c1.O=C(NCC1CC1)c1cc(F)c2n[nH]c(-c3ccc4ccccc4c3)c2c1.O=C(N[C@H](CO)c1ccccc1)c1cc(F)c2n[nH]c(-c3ccc4ccccc4c3)c2c1
InChIInChI=1S/C26H20FN3O2.C23H22FN3O2.C22H18FN3O.C21H18FN3OS.C21H16FN3O/c27-22-14-20(26(32)28-23(15-31)17-7-2-1-3-8-17)13-21-24(29-30-25(21)22)19-11-10-16-6-4-5-9-18(16)12-19;1-13(2)20(12-28)25-23(29)17-10-18-21(26-27-22(18)19(24)11-17)16-8-7-14-5-3-4-6-15(14)9-16;23-19-11-17(22(27)24-12-13-5-6-13)10-18-20(25-26-21(18)19)16-8-7-14-3-1-2-4-15(14)9-16;1-27-9-8-23-21(26)16-11-17-19(24-25-20(17)18(22)12-16)15-7-6-13-4-2-3-5-14(13)10-15;22-18-11-15(21(26)23-16-7-8-16)10-17-19(24-25-20(17)18)14-6-5-12-3-1-2-4-13(12)9-14/h1-14,23,31H,15H2,(H,28,32)(H,29,30);3-11,13,20,28H,12H2,1-2H3,(H,25,29)(H,26,27);1-4,7-11,13H,5-6,12H2,(H,24,27)(H,25,26);2-7,10-12H,8-9H2,1H3,(H,23,26)(H,24,25);1-6,9-11,16H,7-8H2,(H,23,26)(H,24,25)/t23-;20-;;;/m11.../s1
InChIKeyGIPLOPDLKJWAIY-ZHCXYDCASA-N
XLogP22.95
TPSA329.36 Ų
H-Bond Donors12
H-Bond Acceptors13
Rotatable Bonds22
Heavy Atoms141
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001901.15
LogP ≤ 522.95
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-cyclopropyl-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(1S)-2-hydroxy-1-phenylethyl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-(2-methylsulfanylethyl)-3-naphthalen-2-yl-2H-indazole-5-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(1S)-2-hydroxy-1-phenylethyl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-(2-methylsulfanylethyl)-3-naphthalen-2-yl-2H-indazole-5-carboxamide?
The IUPAC name of N-cyclopropyl-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(1S)-2-hydroxy-1-phenylethyl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-(2-methylsulfanylethyl)-3-naphthalen-2-yl-2H-indazole-5-carboxamide (CID 158267317) is N-cyclopropyl-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(1S)-2-hydroxy-1-phenylethyl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-(2-methylsulfanylethyl)-3-naphthalen-2-yl-2H-indazole-5-carboxamide.
What is the SMILES notation for N-cyclopropyl-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(1S)-2-hydroxy-1-phenylethyl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-(2-methylsulfanylethyl)-3-naphthalen-2-yl-2H-indazole-5-carboxamide?
The canonical SMILES for N-cyclopropyl-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(1S)-2-hydroxy-1-phenylethyl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-(2-methylsulfanylethyl)-3-naphthalen-2-yl-2H-indazole-5-carboxamide is CC(C)[C@@H](CO)NC(=O)c1cc(F)c2n[nH]c(-c3ccc4ccccc4c3)c2c1.CSCCNC(=O)c1cc(F)c2n[nH]c(-c3ccc4ccccc4c3)c2c1.O=C(NC1CC1)c1cc(F)c2n[nH]c(-c3ccc4ccccc4c3)c2c1.O=C(NCC1CC1)c1cc(F)c2n[nH]c(-c3ccc4ccccc4c3)c2c1.O=C(N[C@H](CO)c1ccccc1)c1cc(F)c2n[nH]c(-c3ccc4ccccc4c3)c2c1.
What is the InChIKey of N-cyclopropyl-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(1S)-2-hydroxy-1-phenylethyl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-(2-methylsulfanylethyl)-3-naphthalen-2-yl-2H-indazole-5-carboxamide?
The InChIKey is GIPLOPDLKJWAIY-ZHCXYDCASA-N. The full InChI is InChI=1S/C26H20FN3O2.C23H22FN3O2.C22H18FN3O.C21H18FN3OS.C21H16FN3O/c27-22-14-20(26(32)28-23(15-31)17-7-2-1-3-8-17)13-21-24(29-30-25(21)22)19-11-10-16-6-4-5-9-18(16)12-19;1-13(2)20(12-28)25-23(29)17-10-18-21(26-27-22(18)19(24)11-17)16-8-7-14-5-3-4-6-15(14)9-16;23-19-11-17(22(27)24-12-13-5-6-13)10-18-20(25-26-21(18)19)16-8-7-14-3-1-2-4-15(14)9-16;1-27-9-8-23-21(26)16-11-17-19(24-25-20(17)18(22)12-16)15-7-6-13-4-2-3-5-14(13)10-15;22-18-11-15(21(26)23-16-7-8-16)10-17-19(24-25-20(17)18)14-6-5-12-3-1-2-4-13(12)9-14/h1-14,23,31H,15H2,(H,28,32)(H,29,30);3-11,13,20,28H,12H2,1-2H3,(H,25,29)(H,26,27);1-4,7-11,13H,5-6,12H2,(H,24,27)(H,25,26);2-7,10-12H,8-9H2,1H3,(H,23,26)(H,24,25);1-6,9-11,16H,7-8H2,(H,23,26)(H,24,25)/t23-;20-;;;/m11.../s1.
What are the key properties of N-cyclopropyl-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(1S)-2-hydroxy-1-phenylethyl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-(2-methylsulfanylethyl)-3-naphthalen-2-yl-2H-indazole-5-carboxamide?
N-cyclopropyl-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(1S)-2-hydroxy-1-phenylethyl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-(2-methylsulfanylethyl)-3-naphthalen-2-yl-2H-indazole-5-carboxamide has a molecular weight of 1901.15 g/mol, XLogP of 22.95, 22 rotatable bonds, 12 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;N-(cyclopropylmethyl)-7-fluoro-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-[(1S)-2-hydroxy-1-phenylethyl]-3-naphthalen-2-yl-2H-indazole-5-carboxamide;7-fluoro-N-(2-methylsulfanylethyl)-3-naphthalen-2-yl-2H-indazole-5-carboxamide is sourced from PubChem (CID 158267317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).