N-[1-(6-chloro-1H-indazol-4-yl)piperidin-3-yl]methanesulfonamide;1-[3-(6-chloro-1H-indol-4-yl)-3,8-diazabicyclo[3.2.1]octan-8-yl]ethanone;6-chloro-4-[1-(2-methoxyethylsulfonyl)piperidin-4-yl]-1H-indole;6-chloro-4-(5-methylsulfonyl-2,5-diazabicyclo[2.2.2]octan-2-yl)-1H-indole

C60H74Cl4N12O8S3 — CID 161464824

IUPACN-[1-(6-chloro-1H-indazol-4-yl)piperidin-3-yl]methanesulfonamide;1-[3-(6-chloro-1H-indol-4-yl)-3,8-diazabicyclo[3.2.1]octan-8-yl]ethanone;6-chloro-4-[1-(2-methoxyethylsulfonyl)piperidin-4-yl]-1H-indole;6-chloro-4-(5-methylsulfonyl-2,5-diazabicyclo[2.2.2]octan-2-yl)-1H-indole
SMILESCC(=O)N1C2CCC1CN(c1cc(Cl)cc3[nH]ccc13)C2.COCCS(=O)(=O)N1CCC(c2cc(Cl)cc3[nH]ccc23)CC1.CS(=O)(=O)N1CC2CCC1CN2c1cc(Cl)cc2[nH]ccc12.CS(=O)(=O)NC1CCCN(c2cc(Cl)cc3[nH]ncc23)C1
InChIInChI=1S/C16H18ClN3O.C16H21ClN2O3S.C15H18ClN3O2S.C13H17ClN4O2S/c1-10(21)20-12-2-3-13(20)9-19(8-12)16-7-11(17)6-15-14(16)4-5-18-15;1-22-8-9-23(20,21)19-6-3-12(4-7-19)15-10-13(17)11-16-14(15)2-5-18-16;1-22(20,21)19-9-11-2-3-12(19)8-18(11)15-7-10(16)6-14-13(15)4-5-17-14;1-21(19,20)17-10-3-2-4-18(8-10)13-6-9(14)5-12-11(13)7-15-16-12/h4-7,12-13,18H,2-3,8-9H2,1H3;2,5,10-12,18H,3-4,6-9H2,1H3;4-7,11-12,17H,2-3,8-9H2,1H3;5-7,10,17H,2-4,8H2,1H3,(H,15,16)
InChIKeyWCHBDARMGUYQFT-UHFFFAOYSA-N
MW1329.34 g/mol
LogP10.17
Rot. Bonds11

About N-[1-(6-chloro-1H-indazol-4-yl)piperidin-3-yl]methanesulfonamide;1-[3-(6-chloro-1H-indol-4-yl)-3,8-diazabicyclo[3.2.1]octan-8-yl]ethanone;6-chloro-4-[1-(2-methoxyethylsulfonyl)piperidin-4-yl]-1H-indole;6-chloro-4-(5-methylsulfonyl-2,5-diazabicyclo[2.2.2]octan-2-yl)-1H-indole

N-[1-(6-chloro-1H-indazol-4-yl)piperidin-3-yl]methanesulfonamide;1-[3-(6-chloro-1H-indol-4-yl)-3,8-diazabicyclo[3.2.1]octan-8-yl]ethanone;6-chloro-4-[1-(2-methoxyethylsulfonyl)piperidin-4-yl]-1H-indole;6-chloro-4-(5-methylsulfonyl-2,5-diazabicyclo[2.2.2]octan-2-yl)-1H-indole (PubChem CID 161464824) has the molecular formula C60H74Cl4N12O8S3 and a molecular weight of 1329.34 g/mol. Its IUPAC name is N-[1-(6-chloro-1H-indazol-4-yl)piperidin-3-yl]methanesulfonamide;1-[3-(6-chloro-1H-indol-4-yl)-3,8-diazabicyclo[3.2.1]octan-8-yl]ethanone;6-chloro-4-[1-(2-methoxyethylsulfonyl)piperidin-4-yl]-1H-indole;6-chloro-4-(5-methylsulfonyl-2,5-diazabicyclo[2.2.2]octan-2-yl)-1H-indole.

Molecular Properties

Compound NameN-[1-(6-chloro-1H-indazol-4-yl)piperidin-3-yl]methanesulfonamide;1-[3-(6-chloro-1H-indol-4-yl)-3,8-diazabicyclo[3.2.1]octan-8-yl]ethanone;6-chloro-4-[1-(2-methoxyethylsulfonyl)piperidin-4-yl]-1H-indole;6-chloro-4-(5-methylsulfonyl-2,5-diazabicyclo[2.2.2]octan-2-yl)-1H-indole
PubChem CID161464824
Molecular FormulaC60H74Cl4N12O8S3
Molecular Weight1329.34 g/mol
Exact Mass1326.37
IUPAC NameN-[1-(6-chloro-1H-indazol-4-yl)piperidin-3-yl]methanesulfonamide;1-[3-(6-chloro-1H-indol-4-yl)-3,8-diazabicyclo[3.2.1]octan-8-yl]ethanone;6-chloro-4-[1-(2-methoxyethylsulfonyl)piperidin-4-yl]-1H-indole;6-chloro-4-(5-methylsulfonyl-2,5-diazabicyclo[2.2.2]octan-2-yl)-1H-indole
SMILESCC(=O)N1C2CCC1CN(c1cc(Cl)cc3[nH]ccc13)C2.COCCS(=O)(=O)N1CCC(c2cc(Cl)cc3[nH]ccc23)CC1.CS(=O)(=O)N1CC2CCC1CN2c1cc(Cl)cc2[nH]ccc12.CS(=O)(=O)NC1CCCN(c2cc(Cl)cc3[nH]ncc23)C1
InChIInChI=1S/C16H18ClN3O.C16H21ClN2O3S.C15H18ClN3O2S.C13H17ClN4O2S/c1-10(21)20-12-2-3-13(20)9-19(8-12)16-7-11(17)6-15-14(16)4-5-18-15;1-22-8-9-23(20,21)19-6-3-12(4-7-19)15-10-13(17)11-16-14(15)2-5-18-16;1-22(20,21)19-9-11-2-3-12(19)8-18(11)15-7-10(16)6-14-13(15)4-5-17-14;1-21(19,20)17-10-3-2-4-18(8-10)13-6-9(14)5-12-11(13)7-15-16-12/h4-7,12-13,18H,2-3,8-9H2,1H3;2,5,10-12,18H,3-4,6-9H2,1H3;4-7,11-12,17H,2-3,8-9H2,1H3;5-7,10,17H,2-4,8H2,1H3,(H,15,16)
InChIKeyWCHBDARMGUYQFT-UHFFFAOYSA-N
XLogP10.17
TPSA236.24 Ų
H-Bond Donors5
H-Bond Acceptors12
Rotatable Bonds11
Heavy Atoms87
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001329.34
LogP ≤ 510.17
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1012

Analyze N-[1-(6-chloro-1H-indazol-4-yl)piperidin-3-yl]methanesulfonamide;1-[3-(6-chloro-1H-indol-4-yl)-3,8-diazabicyclo[3.2.1]octan-8-yl]ethanone;6-chloro-4-[1-(2-methoxyethylsulfonyl)piperidin-4-yl]-1H-indole;6-chloro-4-(5-methylsulfonyl-2,5-diazabicyclo[2.2.2]octan-2-yl)-1H-indole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-chloro-4-(5-methylsulfonyl-2,5-diazabicyclo[2.2.2]octan-2-yl)-1H-indole
CID 161464826
1-[1-(6-chloro-1H-indazol-4-yl)piperidin-3-yl]ethanone;N-[1-(6-chloro-1H-indol-4-yl)pyrrolidin-3-yl]acetamide;6-chloro-4-[(2R)-2-methyl-4-methylsulfonylpiperazin-1-yl]-1H-indole;6-chloro-4-[(2S)-2-methyl-4-methylsulfonylpiperazin-1-yl]-1H-indole
CID 158303164
N-[4-(6-chloro-1H-indazol-4-yl)cyclohexyl]methanesulfonamide;[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]-(oxetan-3-yl)methanone;1-(6-chloro-1H-indazol-4-yl)piperidine-3-carboxamide;6-chloro-4-[(2S)-2-methyl-4-methylsulfonylpiperazin-1-yl]-1H-indazole
CID 158946055
1-[1-(6-chloro-1H-indazol-4-yl)piperidin-3-yl]ethanone
CID 158303166
4-(1-benzylsulfonylpiperidin-4-yl)-6-chloro-1H-indazole;1-[(2R,6S)-4-(6-chloro-1H-indazol-4-yl)-2,6-dimethylpiperazin-1-yl]ethanone;4-(6-chloro-1H-indazol-4-yl)-N-methylpiperazine-1-sulfonamide;[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]-(1-hydroxycyclopropyl)methanone;N-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-N-methylmethanesulfonamide
CID 159975102
7-(6-chloro-1H-indazol-4-yl)-1,2,5,6,8,8a-hexahydroimidazo[1,5-a]pyrazin-3-one;5-(6-chloro-1H-indazol-4-yl)-2,3,3a,4,6,7-hexahydro-[1,2]thiazolo[2,3-a]pyrazine 1,1-dioxide;1-[4-(6-chloro-1H-indazol-4-yl)-2-ethylpiperazin-1-yl]ethanone;1-[4-(6-cyclopropyl-1H-indazol-4-yl)piperidin-1-yl]ethanone;6-cyclopropyl-4-(1-methylsulfonylpiperidin-4-yl)-1H-indazole
CID 160876899
6-chloro-4-[(2S)-2-methyl-4-methylsulfonylpiperazin-1-yl]-1H-indazole
CID 121326167
N-[4-(6-chloro-1H-indol-4-yl)cyclohexyl]acetamide
CID 157358661
1-[4-(6-chloro-1H-indol-4-yl)-1,4-diazepan-1-yl]ethanone
CID 158915053
5-chloro-2-[1-(2-methoxyethylsulfonyl)piperidin-4-yl]pyridine
CID 136574343
6-chloro-4-pyrrolidin-1-yl-1H-indazole
CID 138559858
4-(4-benzylsulfonylpiperazin-1-yl)-6-chloro-1H-indazole;6-chloro-4-(4-cyclopentylsulfonylpiperazin-1-yl)-1H-indazole;2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]-N-methylacetamide;1-[4-(1H-indazol-4-yl)-1,4-diazepan-1-yl]ethanone;4-(4-methylsulfonyl-1,4-diazepan-1-yl)-1H-indazole
CID 162119972

Frequently Asked Questions

What is the IUPAC name of N-[1-(6-chloro-1H-indazol-4-yl)piperidin-3-yl]methanesulfonamide;1-[3-(6-chloro-1H-indol-4-yl)-3,8-diazabicyclo[3.2.1]octan-8-yl]ethanone;6-chloro-4-[1-(2-methoxyethylsulfonyl)piperidin-4-yl]-1H-indole;6-chloro-4-(5-methylsulfonyl-2,5-diazabicyclo[2.2.2]octan-2-yl)-1H-indole?
The IUPAC name of N-[1-(6-chloro-1H-indazol-4-yl)piperidin-3-yl]methanesulfonamide;1-[3-(6-chloro-1H-indol-4-yl)-3,8-diazabicyclo[3.2.1]octan-8-yl]ethanone;6-chloro-4-[1-(2-methoxyethylsulfonyl)piperidin-4-yl]-1H-indole;6-chloro-4-(5-methylsulfonyl-2,5-diazabicyclo[2.2.2]octan-2-yl)-1H-indole (CID 161464824) is N-[1-(6-chloro-1H-indazol-4-yl)piperidin-3-yl]methanesulfonamide;1-[3-(6-chloro-1H-indol-4-yl)-3,8-diazabicyclo[3.2.1]octan-8-yl]ethanone;6-chloro-4-[1-(2-methoxyethylsulfonyl)piperidin-4-yl]-1H-indole;6-chloro-4-(5-methylsulfonyl-2,5-diazabicyclo[2.2.2]octan-2-yl)-1H-indole.
What is the SMILES notation for N-[1-(6-chloro-1H-indazol-4-yl)piperidin-3-yl]methanesulfonamide;1-[3-(6-chloro-1H-indol-4-yl)-3,8-diazabicyclo[3.2.1]octan-8-yl]ethanone;6-chloro-4-[1-(2-methoxyethylsulfonyl)piperidin-4-yl]-1H-indole;6-chloro-4-(5-methylsulfonyl-2,5-diazabicyclo[2.2.2]octan-2-yl)-1H-indole?
The canonical SMILES for N-[1-(6-chloro-1H-indazol-4-yl)piperidin-3-yl]methanesulfonamide;1-[3-(6-chloro-1H-indol-4-yl)-3,8-diazabicyclo[3.2.1]octan-8-yl]ethanone;6-chloro-4-[1-(2-methoxyethylsulfonyl)piperidin-4-yl]-1H-indole;6-chloro-4-(5-methylsulfonyl-2,5-diazabicyclo[2.2.2]octan-2-yl)-1H-indole is CC(=O)N1C2CCC1CN(c1cc(Cl)cc3[nH]ccc13)C2.COCCS(=O)(=O)N1CCC(c2cc(Cl)cc3[nH]ccc23)CC1.CS(=O)(=O)N1CC2CCC1CN2c1cc(Cl)cc2[nH]ccc12.CS(=O)(=O)NC1CCCN(c2cc(Cl)cc3[nH]ncc23)C1.
What is the InChIKey of N-[1-(6-chloro-1H-indazol-4-yl)piperidin-3-yl]methanesulfonamide;1-[3-(6-chloro-1H-indol-4-yl)-3,8-diazabicyclo[3.2.1]octan-8-yl]ethanone;6-chloro-4-[1-(2-methoxyethylsulfonyl)piperidin-4-yl]-1H-indole;6-chloro-4-(5-methylsulfonyl-2,5-diazabicyclo[2.2.2]octan-2-yl)-1H-indole?
The InChIKey is WCHBDARMGUYQFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18ClN3O.C16H21ClN2O3S.C15H18ClN3O2S.C13H17ClN4O2S/c1-10(21)20-12-2-3-13(20)9-19(8-12)16-7-11(17)6-15-14(16)4-5-18-15;1-22-8-9-23(20,21)19-6-3-12(4-7-19)15-10-13(17)11-16-14(15)2-5-18-16;1-22(20,21)19-9-11-2-3-12(19)8-18(11)15-7-10(16)6-14-13(15)4-5-17-14;1-21(19,20)17-10-3-2-4-18(8-10)13-6-9(14)5-12-11(13)7-15-16-12/h4-7,12-13,18H,2-3,8-9H2,1H3;2,5,10-12,18H,3-4,6-9H2,1H3;4-7,11-12,17H,2-3,8-9H2,1H3;5-7,10,17H,2-4,8H2,1H3,(H,15,16).
What are the key properties of N-[1-(6-chloro-1H-indazol-4-yl)piperidin-3-yl]methanesulfonamide;1-[3-(6-chloro-1H-indol-4-yl)-3,8-diazabicyclo[3.2.1]octan-8-yl]ethanone;6-chloro-4-[1-(2-methoxyethylsulfonyl)piperidin-4-yl]-1H-indole;6-chloro-4-(5-methylsulfonyl-2,5-diazabicyclo[2.2.2]octan-2-yl)-1H-indole?
N-[1-(6-chloro-1H-indazol-4-yl)piperidin-3-yl]methanesulfonamide;1-[3-(6-chloro-1H-indol-4-yl)-3,8-diazabicyclo[3.2.1]octan-8-yl]ethanone;6-chloro-4-[1-(2-methoxyethylsulfonyl)piperidin-4-yl]-1H-indole;6-chloro-4-(5-methylsulfonyl-2,5-diazabicyclo[2.2.2]octan-2-yl)-1H-indole has a molecular weight of 1329.34 g/mol, XLogP of 10.17, 11 rotatable bonds, 5 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(6-chloro-1H-indazol-4-yl)piperidin-3-yl]methanesulfonamide;1-[3-(6-chloro-1H-indol-4-yl)-3,8-diazabicyclo[3.2.1]octan-8-yl]ethanone;6-chloro-4-[1-(2-methoxyethylsulfonyl)piperidin-4-yl]-1H-indole;6-chloro-4-(5-methylsulfonyl-2,5-diazabicyclo[2.2.2]octan-2-yl)-1H-indole is sourced from PubChem (CID 161464824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).