1-(6-chloro-1H-indazol-4-yl)-N,4-dimethylpiperidine-4-carboxamide;8-(6-chloro-1H-indazol-4-yl)-1-methyl-1,3,8-triazaspiro[4.5]decan-4-one;N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-1H-indazole-7-carbonitrile

C60H76Cl3N19O5S — CID 157218185

About 1-(6-chloro-1H-indazol-4-yl)-N,4-dimethylpiperidine-4-carboxamide;8-(6-chloro-1H-indazol-4-yl)-1-methyl-1,3,8-triazaspiro[4.5]decan-4-one;N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-1H-indazole-7-carbonitrile

1-(6-chloro-1H-indazol-4-yl)-N,4-dimethylpiperidine-4-carboxamide;8-(6-chloro-1H-indazol-4-yl)-1-methyl-1,3,8-triazaspiro[4.5]decan-4-one;N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-1H-indazole-7-carbonitrile (PubChem CID 157218185) has the molecular formula C60H76Cl3N19O5S and a molecular weight of 1281.82 g/mol. Its IUPAC name is 1-(6-chloro-1H-indazol-4-yl)-N,4-dimethylpiperidine-4-carboxamide;8-(6-chloro-1H-indazol-4-yl)-1-methyl-1,3,8-triazaspiro[4.5]decan-4-one;N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-1H-indazole-7-carbonitrile.

Molecular Properties

• Compound Name: 1-(6-chloro-1H-indazol-4-yl)-N,4-dimethylpiperidine-4-carboxamide;8-(6-chloro-1H-indazol-4-yl)-1-methyl-1,3,8-triazaspiro[4.5]decan-4-one;N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-1H-indazole-7-carbonitrile
• PubChem CID: 157218185
• Molecular Formula: C60H76Cl3N19O5S
• Molecular Weight: 1281.82 g/mol
• Exact Mass: 1279.51
• IUPAC Name: 1-(6-chloro-1H-indazol-4-yl)-N,4-dimethylpiperidine-4-carboxamide;8-(6-chloro-1H-indazol-4-yl)-1-methyl-1,3,8-triazaspiro[4.5]decan-4-one;N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-1H-indazole-7-carbonitrile
• SMILES: CC(=O)NCCN1CCN(c2cc(Cl)cc3[nH]ncc23)CC1.CC1(C)CN(c2ccc(C#N)c3[nH]ncc23)CCN1S(C)(=O)=O.CN1CNC(=O)C12CCN(c1cc(Cl)cc3[nH]ncc13)CC2.CNC(=O)C1(C)CCN(c2cc(Cl)cc3[nH]ncc23)CC1
• InChI: InChI=1S/C15H18ClN5O.C15H20ClN5O.C15H19ClN4O.C15H19N5O2S/c1-20-9-17-14(22)15(20)2-4-21(5-3-15)13-7-10(16)6-12-11(13)8-18-19-12;1-11(22)17-2-3-20-4-6-21(7-5-20)15-9-12(16)8-14-13(15)10-18-19-14;1-15(14(21)17-2)3-5-20(6-4-15)13-8-10(16)7-12-11(13)9-18-19-12;1-15(2)10-19(6-7-20(15)23(3,21)22)13-5-4-11(8-16)14-12(13)9-17-18-14/h6-8H,2-5,9H2,1H3,(H,17,22)(H,18,19);8-10H,2-7H2,1H3,(H,17,22)(H,18,19);7-9H,3-6H2,1-2H3,(H,17,21)(H,18,19);4-5,9H,6-7,10H2,1-3H3,(H,17,18)
• InChIKey: ASQYHFUQMVGKEA-UHFFFAOYSA-N
• XLogP: 6.91
• TPSA: 282.63 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 16
• Rotatable Bonds: 9
• Heavy Atoms: 88
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1281.82
LogP ≤ 5	6.91
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	16

Frequently Asked Questions

What is the IUPAC name of 1-(6-chloro-1H-indazol-4-yl)-N,4-dimethylpiperidine-4-carboxamide;8-(6-chloro-1H-indazol-4-yl)-1-methyl-1,3,8-triazaspiro[4.5]decan-4-one;N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-1H-indazole-7-carbonitrile?

The IUPAC name of 1-(6-chloro-1H-indazol-4-yl)-N,4-dimethylpiperidine-4-carboxamide;8-(6-chloro-1H-indazol-4-yl)-1-methyl-1,3,8-triazaspiro[4.5]decan-4-one;N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-1H-indazole-7-carbonitrile (CID 157218185) is 1-(6-chloro-1H-indazol-4-yl)-N,4-dimethylpiperidine-4-carboxamide;8-(6-chloro-1H-indazol-4-yl)-1-methyl-1,3,8-triazaspiro[4.5]decan-4-one;N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-1H-indazole-7-carbonitrile.

What is the SMILES notation for 1-(6-chloro-1H-indazol-4-yl)-N,4-dimethylpiperidine-4-carboxamide;8-(6-chloro-1H-indazol-4-yl)-1-methyl-1,3,8-triazaspiro[4.5]decan-4-one;N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-1H-indazole-7-carbonitrile?

The canonical SMILES for 1-(6-chloro-1H-indazol-4-yl)-N,4-dimethylpiperidine-4-carboxamide;8-(6-chloro-1H-indazol-4-yl)-1-methyl-1,3,8-triazaspiro[4.5]decan-4-one;N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-1H-indazole-7-carbonitrile is CC(=O)NCCN1CCN(c2cc(Cl)cc3[nH]ncc23)CC1.CC1(C)CN(c2ccc(C#N)c3[nH]ncc23)CCN1S(C)(=O)=O.CN1CNC(=O)C12CCN(c1cc(Cl)cc3[nH]ncc13)CC2.CNC(=O)C1(C)CCN(c2cc(Cl)cc3[nH]ncc23)CC1.

What is the InChIKey of 1-(6-chloro-1H-indazol-4-yl)-N,4-dimethylpiperidine-4-carboxamide;8-(6-chloro-1H-indazol-4-yl)-1-methyl-1,3,8-triazaspiro[4.5]decan-4-one;N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-1H-indazole-7-carbonitrile?

The InChIKey is ASQYHFUQMVGKEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18ClN5O.C15H20ClN5O.C15H19ClN4O.C15H19N5O2S/c1-20-9-17-14(22)15(20)2-4-21(5-3-15)13-7-10(16)6-12-11(13)8-18-19-12;1-11(22)17-2-3-20-4-6-21(7-5-20)15-9-12(16)8-14-13(15)10-18-19-14;1-15(14(21)17-2)3-5-20(6-4-15)13-8-10(16)7-12-11(13)9-18-19-12;1-15(2)10-19(6-7-20(15)23(3,21)22)13-5-4-11(8-16)14-12(13)9-17-18-14/h6-8H,2-5,9H2,1H3,(H,17,22)(H,18,19);8-10H,2-7H2,1H3,(H,17,22)(H,18,19);7-9H,3-6H2,1-2H3,(H,17,21)(H,18,19);4-5,9H,6-7,10H2,1-3H3,(H,17,18).

What are the key properties of 1-(6-chloro-1H-indazol-4-yl)-N,4-dimethylpiperidine-4-carboxamide;8-(6-chloro-1H-indazol-4-yl)-1-methyl-1,3,8-triazaspiro[4.5]decan-4-one;N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-1H-indazole-7-carbonitrile?

1-(6-chloro-1H-indazol-4-yl)-N,4-dimethylpiperidine-4-carboxamide;8-(6-chloro-1H-indazol-4-yl)-1-methyl-1,3,8-triazaspiro[4.5]decan-4-one;N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-1H-indazole-7-carbonitrile has a molecular weight of 1281.82 g/mol, XLogP of 6.91, 9 rotatable bonds, 7 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(6-chloro-1H-indazol-4-yl)-N,4-dimethylpiperidine-4-carboxamide;8-(6-chloro-1H-indazol-4-yl)-1-methyl-1,3,8-triazaspiro[4.5]decan-4-one;N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-1H-indazole-7-carbonitrile is sourced from PubChem (CID 157218185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).