1-(6-chloro-1H-indazol-4-yl)-N-methylpiperidine-3-carboxamide;5-(6-chloro-1H-indazol-4-yl)-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;N-methyl-N-[4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-6-yl]acetamide;4-[(2S)-2-methyl-4-methylsulfonylpiperazin-1-yl]-6-(trifluoromethyl)-1H-indazole;2-methyl-5-[6-(trifluoromethyl)-1H-indazol-4-yl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine

C72H83Cl2F6N23O6S2 — CID 158202945

IUPAC1-(6-chloro-1H-indazol-4-yl)-N-methylpiperidine-3-carboxamide;5-(6-chloro-1H-indazol-4-yl)-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;N-methyl-N-[4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-6-yl]acetamide;4-[(2S)-2-methyl-4-methylsulfonylpiperazin-1-yl]-6-(trifluoromethyl)-1H-indazole;2-methyl-5-[6-(trifluoromethyl)-1H-indazol-4-yl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESCC(=O)N(C)c1cc(N2CCN(S(C)(=O)=O)CC2)c2cn[nH]c2c1.CNC(=O)C1CCCN(c2cc(Cl)cc3[nH]ncc23)C1.C[C@H]1CN(S(C)(=O)=O)CCN1c1cc(C(F)(F)F)cc2[nH]ncc12.Cc1nc2c([nH]1)CN(c1cc(C(F)(F)F)cc3[nH]ncc13)CC2.Cc1nc2c([nH]1)CN(c1cc(Cl)cc3[nH]ncc13)CC2
InChIInChI=1S/C15H14F3N5.C15H21N5O3S.C14H14ClN5.C14H17ClN4O.C14H17F3N4O2S/c1-8-20-11-2-3-23(7-13(11)21-8)14-5-9(15(16,17)18)4-12-10(14)6-19-22-12;1-11(21)18(2)12-8-14-13(10-16-17-14)15(9-12)19-4-6-20(7-5-19)24(3,22)23;1-8-17-11-2-3-20(7-13(11)18-8)14-5-9(15)4-12-10(14)6-16-19-12;1-16-14(20)9-3-2-4-19(8-9)13-6-10(15)5-12-11(13)7-17-18-12;1-9-8-20(24(2,22)23)3-4-21(9)13-6-10(14(15,16)17)5-12-11(13)7-18-19-12/h4-6H,2-3,7H2,1H3,(H,19,22)(H,20,21);8-10H,4-7H2,1-3H3,(H,16,17);4-6H,2-3,7H2,1H3,(H,16,19)(H,17,18);5-7,9H,2-4,8H2,1H3,(H,16,20)(H,17,18);5-7,9H,3-4,8H2,1-2H3,(H,18,19)/t;;;;9-/m....0/s1
InChIKeyGBDQLNPOTCMDHF-OJQYEMAUSA-N
MW1615.64 g/mol
LogP10.84
Rot. Bonds9

About 1-(6-chloro-1H-indazol-4-yl)-N-methylpiperidine-3-carboxamide;5-(6-chloro-1H-indazol-4-yl)-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;N-methyl-N-[4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-6-yl]acetamide;4-[(2S)-2-methyl-4-methylsulfonylpiperazin-1-yl]-6-(trifluoromethyl)-1H-indazole;2-methyl-5-[6-(trifluoromethyl)-1H-indazol-4-yl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine

1-(6-chloro-1H-indazol-4-yl)-N-methylpiperidine-3-carboxamide;5-(6-chloro-1H-indazol-4-yl)-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;N-methyl-N-[4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-6-yl]acetamide;4-[(2S)-2-methyl-4-methylsulfonylpiperazin-1-yl]-6-(trifluoromethyl)-1H-indazole;2-methyl-5-[6-(trifluoromethyl)-1H-indazol-4-yl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine (PubChem CID 158202945) has the molecular formula C72H83Cl2F6N23O6S2 and a molecular weight of 1615.64 g/mol. Its IUPAC name is 1-(6-chloro-1H-indazol-4-yl)-N-methylpiperidine-3-carboxamide;5-(6-chloro-1H-indazol-4-yl)-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;N-methyl-N-[4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-6-yl]acetamide;4-[(2S)-2-methyl-4-methylsulfonylpiperazin-1-yl]-6-(trifluoromethyl)-1H-indazole;2-methyl-5-[6-(trifluoromethyl)-1H-indazol-4-yl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name1-(6-chloro-1H-indazol-4-yl)-N-methylpiperidine-3-carboxamide;5-(6-chloro-1H-indazol-4-yl)-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;N-methyl-N-[4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-6-yl]acetamide;4-[(2S)-2-methyl-4-methylsulfonylpiperazin-1-yl]-6-(trifluoromethyl)-1H-indazole;2-methyl-5-[6-(trifluoromethyl)-1H-indazol-4-yl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine
PubChem CID158202945
Molecular FormulaC72H83Cl2F6N23O6S2
Molecular Weight1615.64 g/mol
Exact Mass1613.56
IUPAC Name1-(6-chloro-1H-indazol-4-yl)-N-methylpiperidine-3-carboxamide;5-(6-chloro-1H-indazol-4-yl)-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;N-methyl-N-[4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-6-yl]acetamide;4-[(2S)-2-methyl-4-methylsulfonylpiperazin-1-yl]-6-(trifluoromethyl)-1H-indazole;2-methyl-5-[6-(trifluoromethyl)-1H-indazol-4-yl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESCC(=O)N(C)c1cc(N2CCN(S(C)(=O)=O)CC2)c2cn[nH]c2c1.CNC(=O)C1CCCN(c2cc(Cl)cc3[nH]ncc23)C1.C[C@H]1CN(S(C)(=O)=O)CCN1c1cc(C(F)(F)F)cc2[nH]ncc12.Cc1nc2c([nH]1)CN(c1cc(C(F)(F)F)cc3[nH]ncc13)CC2.Cc1nc2c([nH]1)CN(c1cc(Cl)cc3[nH]ncc13)CC2
InChIInChI=1S/C15H14F3N5.C15H21N5O3S.C14H14ClN5.C14H17ClN4O.C14H17F3N4O2S/c1-8-20-11-2-3-23(7-13(11)21-8)14-5-9(15(16,17)18)4-12-10(14)6-19-22-12;1-11(21)18(2)12-8-14-13(10-16-17-14)15(9-12)19-4-6-20(7-5-19)24(3,22)23;1-8-17-11-2-3-20(7-13(11)18-8)14-5-9(15)4-12-10(14)6-16-19-12;1-16-14(20)9-3-2-4-19(8-9)13-6-10(15)5-12-11(13)7-17-18-12;1-9-8-20(24(2,22)23)3-4-21(9)13-6-10(14(15,16)17)5-12-11(13)7-18-19-12/h4-6H,2-3,7H2,1H3,(H,19,22)(H,20,21);8-10H,4-7H2,1-3H3,(H,16,17);4-6H,2-3,7H2,1H3,(H,16,19)(H,17,18);5-7,9H,2-4,8H2,1H3,(H,16,20)(H,17,18);5-7,9H,3-4,8H2,1-2H3,(H,18,19)/t;;;;9-/m....0/s1
InChIKeyGBDQLNPOTCMDHF-OJQYEMAUSA-N
XLogP10.84
TPSA341.13 Ų
H-Bond Donors8
H-Bond Acceptors18
Rotatable Bonds9
Heavy Atoms111
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001615.64
LogP ≤ 510.84
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1018

Analyze 1-(6-chloro-1H-indazol-4-yl)-N-methylpiperidine-3-carboxamide;5-(6-chloro-1H-indazol-4-yl)-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;N-methyl-N-[4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-6-yl]acetamide;4-[(2S)-2-methyl-4-methylsulfonylpiperazin-1-yl]-6-(trifluoromethyl)-1H-indazole;2-methyl-5-[6-(trifluoromethyl)-1H-indazol-4-yl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine with MolForge

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Related Compounds

6-chloro-4-[(2S)-2-methyl-4-methylsulfonylpiperazin-1-yl]-1H-indazole
CID 121326167
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
1-[1-(6-chloro-1H-indazol-4-yl)piperidin-3-yl]ethanone
CID 158303166
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-(6-chloro-1H-indazol-4-yl)-N-methylpiperidine-4-carboxamide
CID 121326810
1-methylsulfonyl-4-[6-(trifluoromethyl)-1H-indazol-4-yl]-2,3,4a,5,6,7,8,8a-octahydroquinoxaline
CID 121326760
2-[4-(6-chloro-1H-indazol-4-yl)-2,2-dimethylpiperazin-1-yl]-N-methylacetamide;N-[2-[8-(6-chloro-1H-indazol-4-yl)-2,4-dioxo-1,3,8-triazaspiro[4.5]decan-3-yl]ethyl]acetamide;methyl 2-[4-(6-chloro-1H-indazol-4-yl)-2,2-dimethylpiperazin-1-yl]acetate;1-methylsulfonyl-4-[6-(trifluoromethyl)-1H-indazol-4-yl]-2,3,4a,5,6,7,8,8a-octahydroquinoxaline
CID 159625005
6-chloro-4-pyrrolidin-1-yl-1H-indazole
CID 138559858
1-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]-2-fluoro-2-methylpropan-1-one
CID 121326428
N-[4-(6-chloro-1H-indazol-4-yl)cyclohexyl]methanesulfonamide;[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]-(oxetan-3-yl)methanone;[4-(6-chloro-1H-indazol-4-yl)piperidin-1-yl]-(oxetan-3-yl)methanone;6-chloro-4-(5-methylsulfonyl-2,5-diazabicyclo[2.2.1]heptan-2-yl)-1H-indazole;4-[4-(1-methylsulfonylpiperidin-4-yl)-1H-indazol-6-yl]morpholine
CID 161437440
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
6-chloro-4-(4-methylsulfonylpiperazin-1-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-1H-indazole;1-[4-(1H-indazol-4-yl)-2,2-dimethylpiperazin-1-yl]ethanone;4-(1H-indazol-4-yl)-N-methylpiperazine-1-sulfonamide;1-[4-(1H-indazol-4-yl)-2-methylpiperazin-1-yl]ethanone;4-(3-methyl-4-methylsulfonylpiperazin-1-yl)-1H-indazole
CID 159295379

Frequently Asked Questions

What is the IUPAC name of 1-(6-chloro-1H-indazol-4-yl)-N-methylpiperidine-3-carboxamide;5-(6-chloro-1H-indazol-4-yl)-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;N-methyl-N-[4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-6-yl]acetamide;4-[(2S)-2-methyl-4-methylsulfonylpiperazin-1-yl]-6-(trifluoromethyl)-1H-indazole;2-methyl-5-[6-(trifluoromethyl)-1H-indazol-4-yl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine?
The IUPAC name of 1-(6-chloro-1H-indazol-4-yl)-N-methylpiperidine-3-carboxamide;5-(6-chloro-1H-indazol-4-yl)-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;N-methyl-N-[4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-6-yl]acetamide;4-[(2S)-2-methyl-4-methylsulfonylpiperazin-1-yl]-6-(trifluoromethyl)-1H-indazole;2-methyl-5-[6-(trifluoromethyl)-1H-indazol-4-yl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine (CID 158202945) is 1-(6-chloro-1H-indazol-4-yl)-N-methylpiperidine-3-carboxamide;5-(6-chloro-1H-indazol-4-yl)-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;N-methyl-N-[4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-6-yl]acetamide;4-[(2S)-2-methyl-4-methylsulfonylpiperazin-1-yl]-6-(trifluoromethyl)-1H-indazole;2-methyl-5-[6-(trifluoromethyl)-1H-indazol-4-yl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine.
What is the SMILES notation for 1-(6-chloro-1H-indazol-4-yl)-N-methylpiperidine-3-carboxamide;5-(6-chloro-1H-indazol-4-yl)-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;N-methyl-N-[4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-6-yl]acetamide;4-[(2S)-2-methyl-4-methylsulfonylpiperazin-1-yl]-6-(trifluoromethyl)-1H-indazole;2-methyl-5-[6-(trifluoromethyl)-1H-indazol-4-yl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine?
The canonical SMILES for 1-(6-chloro-1H-indazol-4-yl)-N-methylpiperidine-3-carboxamide;5-(6-chloro-1H-indazol-4-yl)-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;N-methyl-N-[4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-6-yl]acetamide;4-[(2S)-2-methyl-4-methylsulfonylpiperazin-1-yl]-6-(trifluoromethyl)-1H-indazole;2-methyl-5-[6-(trifluoromethyl)-1H-indazol-4-yl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine is CC(=O)N(C)c1cc(N2CCN(S(C)(=O)=O)CC2)c2cn[nH]c2c1.CNC(=O)C1CCCN(c2cc(Cl)cc3[nH]ncc23)C1.C[C@H]1CN(S(C)(=O)=O)CCN1c1cc(C(F)(F)F)cc2[nH]ncc12.Cc1nc2c([nH]1)CN(c1cc(C(F)(F)F)cc3[nH]ncc13)CC2.Cc1nc2c([nH]1)CN(c1cc(Cl)cc3[nH]ncc13)CC2.
What is the InChIKey of 1-(6-chloro-1H-indazol-4-yl)-N-methylpiperidine-3-carboxamide;5-(6-chloro-1H-indazol-4-yl)-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;N-methyl-N-[4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-6-yl]acetamide;4-[(2S)-2-methyl-4-methylsulfonylpiperazin-1-yl]-6-(trifluoromethyl)-1H-indazole;2-methyl-5-[6-(trifluoromethyl)-1H-indazol-4-yl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine?
The InChIKey is GBDQLNPOTCMDHF-OJQYEMAUSA-N. The full InChI is InChI=1S/C15H14F3N5.C15H21N5O3S.C14H14ClN5.C14H17ClN4O.C14H17F3N4O2S/c1-8-20-11-2-3-23(7-13(11)21-8)14-5-9(15(16,17)18)4-12-10(14)6-19-22-12;1-11(21)18(2)12-8-14-13(10-16-17-14)15(9-12)19-4-6-20(7-5-19)24(3,22)23;1-8-17-11-2-3-20(7-13(11)18-8)14-5-9(15)4-12-10(14)6-16-19-12;1-16-14(20)9-3-2-4-19(8-9)13-6-10(15)5-12-11(13)7-17-18-12;1-9-8-20(24(2,22)23)3-4-21(9)13-6-10(14(15,16)17)5-12-11(13)7-18-19-12/h4-6H,2-3,7H2,1H3,(H,19,22)(H,20,21);8-10H,4-7H2,1-3H3,(H,16,17);4-6H,2-3,7H2,1H3,(H,16,19)(H,17,18);5-7,9H,2-4,8H2,1H3,(H,16,20)(H,17,18);5-7,9H,3-4,8H2,1-2H3,(H,18,19)/t;;;;9-/m....0/s1.
What are the key properties of 1-(6-chloro-1H-indazol-4-yl)-N-methylpiperidine-3-carboxamide;5-(6-chloro-1H-indazol-4-yl)-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;N-methyl-N-[4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-6-yl]acetamide;4-[(2S)-2-methyl-4-methylsulfonylpiperazin-1-yl]-6-(trifluoromethyl)-1H-indazole;2-methyl-5-[6-(trifluoromethyl)-1H-indazol-4-yl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine?
1-(6-chloro-1H-indazol-4-yl)-N-methylpiperidine-3-carboxamide;5-(6-chloro-1H-indazol-4-yl)-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;N-methyl-N-[4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-6-yl]acetamide;4-[(2S)-2-methyl-4-methylsulfonylpiperazin-1-yl]-6-(trifluoromethyl)-1H-indazole;2-methyl-5-[6-(trifluoromethyl)-1H-indazol-4-yl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine has a molecular weight of 1615.64 g/mol, XLogP of 10.84, 9 rotatable bonds, 8 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-chloro-1H-indazol-4-yl)-N-methylpiperidine-3-carboxamide;5-(6-chloro-1H-indazol-4-yl)-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;N-methyl-N-[4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-6-yl]acetamide;4-[(2S)-2-methyl-4-methylsulfonylpiperazin-1-yl]-6-(trifluoromethyl)-1H-indazole;2-methyl-5-[6-(trifluoromethyl)-1H-indazol-4-yl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine is sourced from PubChem (CID 158202945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).