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-3-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-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-(2-methylsulfanylethyl)-3-naphthalen-2-yl-2H-indazole-5-carboxamide

C107H88F6N16O6S — CID 157385020

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-3-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-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-(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(NCc1cccnc1)c1cc(F)c2n[nH]c(-c3cccc(F)c3)c2c1
InChIInChI=1S/C23H22FN3O2.C22H18FN3O.C21H18FN3OS.C21H16FN3O.C20H14F2N4O/c1-13(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;21-15-5-1-4-13(7-15)18-16-8-14(9-17(22)19(16)26-25-18)20(27)24-11-12-3-2-6-23-10-12/h3-11,13,20,28H,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);1-10H,11H2,(H,24,27)(H,25,26)/t20-;;;;/m1..../s1
InChIKeyBLIGICUDTOQHJX-YFDXKITBSA-N
MW1840.04 g/mol
LogP21.79
Rot. Bonds21

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-3-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-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-(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-3-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-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-(2-methylsulfanylethyl)-3-naphthalen-2-yl-2H-indazole-5-carboxamide (PubChem CID 157385020) has the molecular formula C107H88F6N16O6S and a molecular weight of 1840.04 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-3-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-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-(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-3-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-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-(2-methylsulfanylethyl)-3-naphthalen-2-yl-2H-indazole-5-carboxamide
PubChem CID157385020
Molecular FormulaC107H88F6N16O6S
Molecular Weight1840.04 g/mol
Exact Mass1838.67
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-3-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-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-(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(NCc1cccnc1)c1cc(F)c2n[nH]c(-c3cccc(F)c3)c2c1
InChIInChI=1S/C23H22FN3O2.C22H18FN3O.C21H18FN3OS.C21H16FN3O.C20H14F2N4O/c1-13(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;21-15-5-1-4-13(7-15)18-16-8-14(9-17(22)19(16)26-25-18)20(27)24-11-12-3-2-6-23-10-12/h3-11,13,20,28H,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);1-10H,11H2,(H,24,27)(H,25,26)/t20-;;;;/m1..../s1
InChIKeyBLIGICUDTOQHJX-YFDXKITBSA-N
XLogP21.79
TPSA322.02 Ų
H-Bond Donors11
H-Bond Acceptors13
Rotatable Bonds21
Heavy Atoms136
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001840.04
LogP ≤ 521.79
H-Bond Donors ≤ 511
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-3-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-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-(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-3-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-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-(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-3-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-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-(2-methylsulfanylethyl)-3-naphthalen-2-yl-2H-indazole-5-carboxamide (CID 157385020) 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-3-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-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-(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-3-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-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-(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-3-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-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-(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(NCc1cccnc1)c1cc(F)c2n[nH]c(-c3cccc(F)c3)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-3-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-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-(2-methylsulfanylethyl)-3-naphthalen-2-yl-2H-indazole-5-carboxamide?
The InChIKey is BLIGICUDTOQHJX-YFDXKITBSA-N. The full InChI is InChI=1S/C23H22FN3O2.C22H18FN3O.C21H18FN3OS.C21H16FN3O.C20H14F2N4O/c1-13(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;21-15-5-1-4-13(7-15)18-16-8-14(9-17(22)19(16)26-25-18)20(27)24-11-12-3-2-6-23-10-12/h3-11,13,20,28H,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);1-10H,11H2,(H,24,27)(H,25,26)/t20-;;;;/m1..../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-3-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-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-(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-3-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-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-(2-methylsulfanylethyl)-3-naphthalen-2-yl-2H-indazole-5-carboxamide has a molecular weight of 1840.04 g/mol, XLogP of 21.79, 21 rotatable bonds, 11 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-3-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-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-(2-methylsulfanylethyl)-3-naphthalen-2-yl-2H-indazole-5-carboxamide is sourced from PubChem (CID 157385020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).