5-bromo-3-(5-fluoro-2-pyridinyl)-1H-indazole;tert-butyl 4-aminopiperidine-1-carboxylate;3-(5-fluoro-2-pyridinyl)-1H-indazole-5-carboxylic acid;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-indazole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-isoindole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-piperidin-4-yl-1H-indazole-5-carboxamide

C92H94BrF5N22O7 — CID 161233428

IUPAC5-bromo-3-(5-fluoro-2-pyridinyl)-1H-indazole;tert-butyl 4-aminopiperidine-1-carboxylate;3-(5-fluoro-2-pyridinyl)-1H-indazole-5-carboxylic acid;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-indazole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-isoindole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-piperidin-4-yl-1H-indazole-5-carboxamide
SMILESCC(C)(C)OC(=O)N1CCC(N)CC1.CN1CCC(NC(=O)c2ccc3[nH]nc(-c4ccc(F)cn4)c3c2)CC1.CN1CCC(NC(=O)c2ccc3c(c2)C(c2ccc(F)cn2)=NC3)CC1.Fc1ccc(-c2n[nH]c3ccc(Br)cc23)nc1.O=C(NC1CCNCC1)c1ccc2[nH]nc(-c3ccc(F)cn3)c2c1.O=C(O)c1ccc2[nH]nc(-c3ccc(F)cn3)c2c1
InChIInChI=1S/C20H21FN4O.C19H20FN5O.C18H18FN5O.C13H8FN3O2.C12H7BrFN3.C10H20N2O2/c1-25-8-6-16(7-9-25)24-20(26)13-2-3-14-11-23-19(17(14)10-13)18-5-4-15(21)12-22-18;1-25-8-6-14(7-9-25)22-19(26)12-2-4-16-15(10-12)18(24-23-16)17-5-3-13(20)11-21-17;19-12-2-4-16(21-10-12)17-14-9-11(1-3-15(14)23-24-17)18(25)22-13-5-7-20-8-6-13;14-8-2-4-11(15-6-8)12-9-5-7(13(18)19)1-3-10(9)16-17-12;13-7-1-3-10-9(5-7)12(17-16-10)11-4-2-8(14)6-15-11;1-10(2,3)14-9(13)12-6-4-8(11)5-7-12/h2-5,10,12,16H,6-9,11H2,1H3,(H,24,26);2-5,10-11,14H,6-9H2,1H3,(H,22,26)(H,23,24);1-4,9-10,13,20H,5-8H2,(H,22,25)(H,23,24);1-6H,(H,16,17)(H,18,19);1-6H,(H,16,17);8H,4-7,11H2,1-3H3
InChIKeyUZBFJAGSJXWZOS-UHFFFAOYSA-N
MW1794.80 g/mol
LogP14.56
Rot. Bonds12

About 5-bromo-3-(5-fluoro-2-pyridinyl)-1H-indazole;tert-butyl 4-aminopiperidine-1-carboxylate;3-(5-fluoro-2-pyridinyl)-1H-indazole-5-carboxylic acid;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-indazole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-isoindole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-piperidin-4-yl-1H-indazole-5-carboxamide

5-bromo-3-(5-fluoro-2-pyridinyl)-1H-indazole;tert-butyl 4-aminopiperidine-1-carboxylate;3-(5-fluoro-2-pyridinyl)-1H-indazole-5-carboxylic acid;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-indazole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-isoindole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-piperidin-4-yl-1H-indazole-5-carboxamide (PubChem CID 161233428) has the molecular formula C92H94BrF5N22O7 and a molecular weight of 1794.80 g/mol. Its IUPAC name is 5-bromo-3-(5-fluoro-2-pyridinyl)-1H-indazole;tert-butyl 4-aminopiperidine-1-carboxylate;3-(5-fluoro-2-pyridinyl)-1H-indazole-5-carboxylic acid;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-indazole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-isoindole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-piperidin-4-yl-1H-indazole-5-carboxamide.

Molecular Properties

Compound Name5-bromo-3-(5-fluoro-2-pyridinyl)-1H-indazole;tert-butyl 4-aminopiperidine-1-carboxylate;3-(5-fluoro-2-pyridinyl)-1H-indazole-5-carboxylic acid;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-indazole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-isoindole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-piperidin-4-yl-1H-indazole-5-carboxamide
PubChem CID161233428
Molecular FormulaC92H94BrF5N22O7
Molecular Weight1794.80 g/mol
Exact Mass1792.68
IUPAC Name5-bromo-3-(5-fluoro-2-pyridinyl)-1H-indazole;tert-butyl 4-aminopiperidine-1-carboxylate;3-(5-fluoro-2-pyridinyl)-1H-indazole-5-carboxylic acid;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-indazole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-isoindole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-piperidin-4-yl-1H-indazole-5-carboxamide
SMILESCC(C)(C)OC(=O)N1CCC(N)CC1.CN1CCC(NC(=O)c2ccc3[nH]nc(-c4ccc(F)cn4)c3c2)CC1.CN1CCC(NC(=O)c2ccc3c(c2)C(c2ccc(F)cn2)=NC3)CC1.Fc1ccc(-c2n[nH]c3ccc(Br)cc23)nc1.O=C(NC1CCNCC1)c1ccc2[nH]nc(-c3ccc(F)cn3)c2c1.O=C(O)c1ccc2[nH]nc(-c3ccc(F)cn3)c2c1
InChIInChI=1S/C20H21FN4O.C19H20FN5O.C18H18FN5O.C13H8FN3O2.C12H7BrFN3.C10H20N2O2/c1-25-8-6-16(7-9-25)24-20(26)13-2-3-14-11-23-19(17(14)10-13)18-5-4-15(21)12-22-18;1-25-8-6-14(7-9-25)22-19(26)12-2-4-16-15(10-12)18(24-23-16)17-5-3-13(20)11-21-17;19-12-2-4-16(21-10-12)17-14-9-11(1-3-15(14)23-24-17)18(25)22-13-5-7-20-8-6-13;14-8-2-4-11(15-6-8)12-9-5-7(13(18)19)1-3-10(9)16-17-12;13-7-1-3-10-9(5-7)12(17-16-10)11-4-2-8(14)6-15-11;1-10(2,3)14-9(13)12-6-4-8(11)5-7-12/h2-5,10,12,16H,6-9,11H2,1H3,(H,24,26);2-5,10-11,14H,6-9H2,1H3,(H,22,26)(H,23,24);1-4,9-10,13,20H,5-8H2,(H,22,25)(H,23,24);1-6H,(H,16,17)(H,18,19);1-6H,(H,16,17);8H,4-7,11H2,1-3H3
InChIKeyUZBFJAGSJXWZOS-UHFFFAOYSA-N
XLogP14.56
TPSA390.20 Ų
H-Bond Donors10
H-Bond Acceptors20
Rotatable Bonds12
Heavy Atoms127
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001794.80
LogP ≤ 514.56
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1020

Analyze 5-bromo-3-(5-fluoro-2-pyridinyl)-1H-indazole;tert-butyl 4-aminopiperidine-1-carboxylate;3-(5-fluoro-2-pyridinyl)-1H-indazole-5-carboxylic acid;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-indazole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-isoindole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-piperidin-4-yl-1H-indazole-5-carboxamide with MolForge

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Related Compounds

1-bromo-3-(trifluoromethyl)benzene;1-(1H-indazol-5-yl)ethanone;1-(3-methylphenyl)indazole-5-carboxylic acid;1-[1-(3-methylphenyl)indazol-5-yl]ethanone;trans-(1R,2R)-1-N,2-N-dimethylcyclohexane-1,2-diamine;2-[3-(trifluoromethyl)phenyl]indazole-5-carboxylic acid;1-[2-[3-(trifluoromethyl)phenyl]indazol-5-yl]ethanone
CID 157433074
1-bromo-3-(trifluoromethyl)benzene;1-(1H-indazol-5-yl)ethanone;1-(3-methylphenyl)indole-5-carboxylic acid;1-[1-(3-methylphenyl)indol-5-yl]ethanone;trans-(1R,2R)-1,2-diethylcyclohexane;2-[3-(trifluoromethyl)phenyl]indazole-5-carboxylic acid;1-[2-[3-(trifluoromethyl)phenyl]indazol-5-yl]ethanone
CID 158303325
N-cyano-3-[[1-[2-(4,4-difluoropiperidin-1-yl)ethyl]-5-methylindazol-3-yl]methyl]pyridine-4-carboxamide;N-cyano-3-[[5-fluoro-1-[2-(3-fluoro-3-methylpyrrolidin-1-yl)ethyl]indazol-3-yl]methyl]pyridine-4-carboxamide;3-[[1-[2-(4,4-difluoropiperidin-1-yl)ethyl]-5-methylindazol-3-yl]methyl]pyridine-4-carboxylic acid;3-[[5-fluoro-1-[2-(3-fluoro-3-methylpyrrolidin-1-yl)ethyl]indazol-3-yl]methyl]pyridine-4-carboxylic acid
CID 161624921
5-[5-(aminomethyl)-3-pyridinyl]-N-[5-(3-ethylphenyl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-(aminomethyl)-3-pyridinyl]-N-[5-(3-propylphenyl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-bromo-1-(oxan-2-yl)indazole-3-carboxylic acid;5-bromo-1-(oxan-2-yl)-N-[5-(3-propylphenyl)-3-pyridinyl]indazole-3-carboxamide;tert-butyl 3-[5-[1-(oxan-2-yl)-3-[[5-(3-propylphenyl)-3-pyridinyl]carbamoyl]indazol-5-yl]-3-pyridinyl]propanoate;tert-butyl 3-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-pyridinyl]propanoate;pentakis(carbon dioxide);2,2-diiodopropane;ethane;4,8,19,22,25,26-hexazahexacyclo[22.5.2.12,6.112,16.117,21.027,31]tetratriaconta-1(30),2,4,6(34),12(33),13,15,17(32),18,20,24,27(31),28-tridecaene-9,23-dione;2-iodopropane;methane;propane;5-(3-propylphenyl)pyridin-3-amine;1,2,2-triiodopropane;triiodovanadium;bis(vanadium)
CID 157335266
5-bromo-1H-indazole-3-carboxylic acid;5-bromo-N-pyridin-3-yl-1H-indazole-3-carboxamide;ethane;(5-fluoro-3-pyridinyl)boronic acid;5-(5-fluoro-3-pyridinyl)-N-pyridin-3-yl-1H-indazole-3-carboxamide;2-iodo-2-methylpropane;methane;2-methylpropane;propane;pyridin-3-amine;tris(vanadium)
CID 157409353
(4R)-4-[3-[3-(1-aminoethenyl)-4-fluorophenyl]-2-pyridinyl]-1-[3,5-bis(difluoromethyl)-4-ethenylpyrazol-1-yl]-5-(3,5-difluorophenyl)pentan-2-one;(4R)-4-[3-[3-(1-aminoethenyl)-4-fluorophenyl]-2-pyridinyl]-1-[4-bromo-3,5-bis(difluoromethyl)pyrazol-1-yl]-5-(3,5-difluorophenyl)pentan-2-one;3-[2-[(1S)-1-[[2-[5-(aminomethyl)-1H-indol-3-yl]acetyl]amino]-2-(3,5-difluorophenyl)ethyl]-3-pyridinyl]-N-methylbenzamide;tert-butyl 3-[3-[2-[[(1S)-2-(3,5-difluorophenyl)-1-[3-(4-methylphenyl)-2-pyridinyl]ethyl]amino]-2-oxoethyl]-1H-indol-5-yl]propanoate;5-[2-[(1S)-1-[(2-cyclopentyl-2-phenylacetyl)amino]-2-(3,5-difluorophenyl)ethyl]-3-pyridinyl]-2-fluoro-N-methylbenzamide
CID 157418258
5-bromo-1H-indazole-3-carboxylic acid;6-bromo-N-pyridin-3-yl-3H-indene-1-carboxamide;(5-fluoro-3-pyridinyl)boronic acid;5-(5-fluoro-3-pyridinyl)-N-pyridin-3-yl-1H-indazole-3-carboxamide;2-iodo-2-methylpropane;2-methylpropane;pyridin-3-amine;vanadium
CID 157912402
6-bromo-1H-indole-2-carboxylic acid;6-bromo-N-pyridazin-4-yl-1H-indole-2-carboxamide;tert-butyl 4-(4-aminophenyl)pyrazole-1-carboxylate;6-[4-(1H-pyrazol-4-yl)anilino]-N-pyridazin-4-yl-1H-indole-2-carboxamide;pyridazin-4-amine
CID 157971371
5-bromo-2-fluorobenzoic acid;5-bromo-2-fluoro-N,N-dimethylbenzamide;(5-bromo-2-fluorophenyl)-(1H-pyrrol-2-yl)methanone;5-bromo-3-(1H-pyrrol-2-yl)-1H-indazole;5-pyridin-3-yl-3-(1H-pyrrol-2-yl)-1H-indazole
CID 158151177
5-bromo-1H-indazole-3-carboxylic acid;5-bromo-N-pyridin-3-yl-1H-indazole-3-carboxamide;ethane;(5-fluoro-3-pyridinyl)boronic acid;5-(5-fluoro-3-pyridinyl)-N-pyridin-3-yl-1H-indazole-3-carboxamide;2-iodo-2-methylpropane;2-methylpropane;propane;pyridin-3-amine;tris(vanadium)
CID 158825539
5-bromo-1H-indazole-3-carboxylic acid;5-bromo-N-pyridin-3-yl-1H-indazole-3-carboxamide;(5-fluoro-3-pyridinyl)boronic acid;5-(5-fluoro-3-pyridinyl)-N-pyridin-3-yl-1H-indazole-3-carboxamide;2-iodo-2-methylpropane;methane;2-methylpropane;pyridin-3-amine;vanadium
CID 159467286
6-bromo-1H-indole-2-carboxylic acid;6-bromo-N-pyridazin-4-yl-1H-indole-2-carboxamide;tert-butyl 4-(4-aminophenyl)pyrazole-1-carboxylate;methane;6-[4-(1H-pyrazol-4-yl)anilino]-N-pyridazin-4-yl-1H-indole-2-carboxamide;pyridazin-4-amine
CID 159468993

Frequently Asked Questions

What is the IUPAC name of 5-bromo-3-(5-fluoro-2-pyridinyl)-1H-indazole;tert-butyl 4-aminopiperidine-1-carboxylate;3-(5-fluoro-2-pyridinyl)-1H-indazole-5-carboxylic acid;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-indazole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-isoindole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-piperidin-4-yl-1H-indazole-5-carboxamide?
The IUPAC name of 5-bromo-3-(5-fluoro-2-pyridinyl)-1H-indazole;tert-butyl 4-aminopiperidine-1-carboxylate;3-(5-fluoro-2-pyridinyl)-1H-indazole-5-carboxylic acid;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-indazole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-isoindole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-piperidin-4-yl-1H-indazole-5-carboxamide (CID 161233428) is 5-bromo-3-(5-fluoro-2-pyridinyl)-1H-indazole;tert-butyl 4-aminopiperidine-1-carboxylate;3-(5-fluoro-2-pyridinyl)-1H-indazole-5-carboxylic acid;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-indazole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-isoindole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-piperidin-4-yl-1H-indazole-5-carboxamide.
What is the SMILES notation for 5-bromo-3-(5-fluoro-2-pyridinyl)-1H-indazole;tert-butyl 4-aminopiperidine-1-carboxylate;3-(5-fluoro-2-pyridinyl)-1H-indazole-5-carboxylic acid;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-indazole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-isoindole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-piperidin-4-yl-1H-indazole-5-carboxamide?
The canonical SMILES for 5-bromo-3-(5-fluoro-2-pyridinyl)-1H-indazole;tert-butyl 4-aminopiperidine-1-carboxylate;3-(5-fluoro-2-pyridinyl)-1H-indazole-5-carboxylic acid;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-indazole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-isoindole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-piperidin-4-yl-1H-indazole-5-carboxamide is CC(C)(C)OC(=O)N1CCC(N)CC1.CN1CCC(NC(=O)c2ccc3[nH]nc(-c4ccc(F)cn4)c3c2)CC1.CN1CCC(NC(=O)c2ccc3c(c2)C(c2ccc(F)cn2)=NC3)CC1.Fc1ccc(-c2n[nH]c3ccc(Br)cc23)nc1.O=C(NC1CCNCC1)c1ccc2[nH]nc(-c3ccc(F)cn3)c2c1.O=C(O)c1ccc2[nH]nc(-c3ccc(F)cn3)c2c1.
What is the InChIKey of 5-bromo-3-(5-fluoro-2-pyridinyl)-1H-indazole;tert-butyl 4-aminopiperidine-1-carboxylate;3-(5-fluoro-2-pyridinyl)-1H-indazole-5-carboxylic acid;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-indazole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-isoindole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-piperidin-4-yl-1H-indazole-5-carboxamide?
The InChIKey is UZBFJAGSJXWZOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21FN4O.C19H20FN5O.C18H18FN5O.C13H8FN3O2.C12H7BrFN3.C10H20N2O2/c1-25-8-6-16(7-9-25)24-20(26)13-2-3-14-11-23-19(17(14)10-13)18-5-4-15(21)12-22-18;1-25-8-6-14(7-9-25)22-19(26)12-2-4-16-15(10-12)18(24-23-16)17-5-3-13(20)11-21-17;19-12-2-4-16(21-10-12)17-14-9-11(1-3-15(14)23-24-17)18(25)22-13-5-7-20-8-6-13;14-8-2-4-11(15-6-8)12-9-5-7(13(18)19)1-3-10(9)16-17-12;13-7-1-3-10-9(5-7)12(17-16-10)11-4-2-8(14)6-15-11;1-10(2,3)14-9(13)12-6-4-8(11)5-7-12/h2-5,10,12,16H,6-9,11H2,1H3,(H,24,26);2-5,10-11,14H,6-9H2,1H3,(H,22,26)(H,23,24);1-4,9-10,13,20H,5-8H2,(H,22,25)(H,23,24);1-6H,(H,16,17)(H,18,19);1-6H,(H,16,17);8H,4-7,11H2,1-3H3.
What are the key properties of 5-bromo-3-(5-fluoro-2-pyridinyl)-1H-indazole;tert-butyl 4-aminopiperidine-1-carboxylate;3-(5-fluoro-2-pyridinyl)-1H-indazole-5-carboxylic acid;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-indazole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-isoindole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-piperidin-4-yl-1H-indazole-5-carboxamide?
5-bromo-3-(5-fluoro-2-pyridinyl)-1H-indazole;tert-butyl 4-aminopiperidine-1-carboxylate;3-(5-fluoro-2-pyridinyl)-1H-indazole-5-carboxylic acid;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-indazole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-isoindole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-piperidin-4-yl-1H-indazole-5-carboxamide has a molecular weight of 1794.80 g/mol, XLogP of 14.56, 12 rotatable bonds, 10 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-(5-fluoro-2-pyridinyl)-1H-indazole;tert-butyl 4-aminopiperidine-1-carboxylate;3-(5-fluoro-2-pyridinyl)-1H-indazole-5-carboxylic acid;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-indazole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-(1-methylpiperidin-4-yl)-1H-isoindole-5-carboxamide;3-(5-fluoro-2-pyridinyl)-N-piperidin-4-yl-1H-indazole-5-carboxamide is sourced from PubChem (CID 161233428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).