N-(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)-2-thiophen-2-ylacetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)acetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide

C65H52FN9O5S — CID 159592790

IUPACN-(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)-2-thiophen-2-ylacetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)acetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide
SMILESCOc1c(NC(=O)C2CC2)ccc2[nH]nc(-c3ccc4ccccc4c3)c12.COc1c(NC(C)=O)ccc2[nH]nc(-c3ccc4ccccc4c3)c12.O=C(Cc1cccs1)Nc1cc(F)c2n[nH]c(-c3ccc4ccccc4c3)c2c1
InChIInChI=1S/C23H16FN3OS.C22H19N3O2.C20H17N3O2/c24-20-12-17(25-21(28)13-18-6-3-9-29-18)11-19-22(26-27-23(19)20)16-8-7-14-4-1-2-5-15(14)10-16;1-27-21-18(23-22(26)14-7-8-14)11-10-17-19(21)20(25-24-17)16-9-6-13-4-2-3-5-15(13)12-16;1-12(24)21-17-10-9-16-18(20(17)25-2)19(23-22-16)15-8-7-13-5-3-4-6-14(13)11-15/h1-12H,13H2,(H,25,28)(H,26,27);2-6,9-12,14H,7-8H2,1H3,(H,23,26)(H,24,25);3-11H,1-2H3,(H,21,24)(H,22,23)
InChIKeyMKLJQISKTQDGAV-UHFFFAOYSA-N
MW1090.25 g/mol
LogP14.86
Rot. Bonds11

About N-(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)-2-thiophen-2-ylacetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)acetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide

N-(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)-2-thiophen-2-ylacetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)acetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide (PubChem CID 159592790) has the molecular formula C65H52FN9O5S and a molecular weight of 1090.25 g/mol. Its IUPAC name is N-(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)-2-thiophen-2-ylacetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)acetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)-2-thiophen-2-ylacetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)acetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide
PubChem CID159592790
Molecular FormulaC65H52FN9O5S
Molecular Weight1090.25 g/mol
Exact Mass1089.38
IUPAC NameN-(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)-2-thiophen-2-ylacetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)acetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide
SMILESCOc1c(NC(=O)C2CC2)ccc2[nH]nc(-c3ccc4ccccc4c3)c12.COc1c(NC(C)=O)ccc2[nH]nc(-c3ccc4ccccc4c3)c12.O=C(Cc1cccs1)Nc1cc(F)c2n[nH]c(-c3ccc4ccccc4c3)c2c1
InChIInChI=1S/C23H16FN3OS.C22H19N3O2.C20H17N3O2/c24-20-12-17(25-21(28)13-18-6-3-9-29-18)11-19-22(26-27-23(19)20)16-8-7-14-4-1-2-5-15(14)10-16;1-27-21-18(23-22(26)14-7-8-14)11-10-17-19(21)20(25-24-17)16-9-6-13-4-2-3-5-15(13)12-16;1-12(24)21-17-10-9-16-18(20(17)25-2)19(23-22-16)15-8-7-13-5-3-4-6-14(13)11-15/h1-12H,13H2,(H,25,28)(H,26,27);2-6,9-12,14H,7-8H2,1H3,(H,23,26)(H,24,25);3-11H,1-2H3,(H,21,24)(H,22,23)
InChIKeyMKLJQISKTQDGAV-UHFFFAOYSA-N
XLogP14.86
TPSA191.80 Ų
H-Bond Donors6
H-Bond Acceptors9
Rotatable Bonds11
Heavy Atoms81
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001090.25
LogP ≤ 514.86
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 109

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Related Compounds

N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-thiophen-2-ylacetamide
CID 22260787
N-[3-(3-fluorocyclohexyl)-6-methoxy-2H-indazol-5-yl]-2-thiophen-2-ylacetamide
CID 142179186
N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)-2-thiophen-2-ylacetamide
CID 22260949
N-[3-(1-benzothiophen-2-yl)-4-methoxy-1H-indazol-5-yl]-2-thiophen-2-ylacetamide
CID 22261079
N-[3-(1-benzothiophen-2-yl)-4-methoxy-1H-indazol-5-yl]cyclopropanecarboxamide
CID 23589923
N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)thiophene-2-carboxamide
CID 23589944
N-[3-(1-benzothiophen-2-yl)-4-methoxy-1H-indazol-5-yl]-2-(2,3-dihydrothiophen-2-yl)acetamide
CID 70955665
N-[3-(6,7-dihydro-1-benzothiophen-2-yl)-4-methoxy-1H-indazol-5-yl]cyclopropanecarboxamide
CID 142179047
(E)-N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-cyclopropylprop-2-enamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-2,3-dihydro-1-benzofuran-7-carboxamide;N-[3-(1-benzothiophen-2-yl)-1H-indazol-5-yl]-3-thiophen-2-ylpropanamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide;N-(3-naphthalen-2-yl-1H-indazol-5-yl)thiophene-2-carboxamide
CID 158188335
N-(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)oxolane-2-carboxamide;N-(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)-2-thiophen-2-ylacetamide;N-(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)-2-thiophen-3-ylacetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)acetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide
CID 158192964
N-[3-(1-benzothiophen-2-yl)-4-methoxy-1H-indazol-5-yl]-3-(dimethylamino)propanamide;N-[3-(1-benzothiophen-2-yl)-4-methoxy-1H-indazol-5-yl]-3-methoxypropanamide;N-[3-(1-benzothiophen-2-yl)-4-methoxy-1H-indazol-5-yl]thiophene-2-carboxamide;N-[3-(1-benzothiophen-2-yl)-4-methoxy-1H-indazol-5-yl]-2-thiophen-2-ylacetamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-3-methoxybenzamide
CID 158271076
N-[3-(1-benzothiophen-2-yl)-4-methoxy-1H-indazol-5-yl]acetamide;N-[3-(1-benzothiophen-2-yl)-4-methoxy-1H-indazol-5-yl]cyclopropanecarboxamide;(2S)-N-[3-(1-benzothiophen-2-yl)-4-methoxy-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;(2R)-N-[3-(1-benzothiophen-2-yl)-4-methoxy-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;3-(dimethylamino)-N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)propanamide
CID 162129301

Frequently Asked Questions

What is the IUPAC name of N-(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)-2-thiophen-2-ylacetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)acetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide?
The IUPAC name of N-(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)-2-thiophen-2-ylacetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)acetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide (CID 159592790) is N-(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)-2-thiophen-2-ylacetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)acetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide.
What is the SMILES notation for N-(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)-2-thiophen-2-ylacetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)acetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide?
The canonical SMILES for N-(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)-2-thiophen-2-ylacetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)acetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide is COc1c(NC(=O)C2CC2)ccc2[nH]nc(-c3ccc4ccccc4c3)c12.COc1c(NC(C)=O)ccc2[nH]nc(-c3ccc4ccccc4c3)c12.O=C(Cc1cccs1)Nc1cc(F)c2n[nH]c(-c3ccc4ccccc4c3)c2c1.
What is the InChIKey of N-(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)-2-thiophen-2-ylacetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)acetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide?
The InChIKey is MKLJQISKTQDGAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16FN3OS.C22H19N3O2.C20H17N3O2/c24-20-12-17(25-21(28)13-18-6-3-9-29-18)11-19-22(26-27-23(19)20)16-8-7-14-4-1-2-5-15(14)10-16;1-27-21-18(23-22(26)14-7-8-14)11-10-17-19(21)20(25-24-17)16-9-6-13-4-2-3-5-15(13)12-16;1-12(24)21-17-10-9-16-18(20(17)25-2)19(23-22-16)15-8-7-13-5-3-4-6-14(13)11-15/h1-12H,13H2,(H,25,28)(H,26,27);2-6,9-12,14H,7-8H2,1H3,(H,23,26)(H,24,25);3-11H,1-2H3,(H,21,24)(H,22,23).
What are the key properties of N-(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)-2-thiophen-2-ylacetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)acetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide?
N-(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)-2-thiophen-2-ylacetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)acetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide has a molecular weight of 1090.25 g/mol, XLogP of 14.86, 11 rotatable bonds, 6 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)-2-thiophen-2-ylacetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)acetamide;N-(4-methoxy-3-naphthalen-2-yl-1H-indazol-5-yl)cyclopropanecarboxamide is sourced from PubChem (CID 159592790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).