8-(6-chloro-1H-indazol-4-yl)-3-(cyclohexylmethyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;8-(6-chloro-1H-indazol-4-yl)-3-[2-(dimethylamino)ethyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione;(1R,5S)-3-(6-chloro-1H-indol-4-yl)-3,6-diazabicyclo[3.2.2]nonan-7-one;3-(6-chloro-1H-indol-4-yl)-3,10-diazaspiro[5.6]dodecan-9-one

C72H87Cl4N17O6 — CID 157162653

About 8-(6-chloro-1H-indazol-4-yl)-3-(cyclohexylmethyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;8-(6-chloro-1H-indazol-4-yl)-3-[2-(dimethylamino)ethyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione;(1R,5S)-3-(6-chloro-1H-indol-4-yl)-3,6-diazabicyclo[3.2.2]nonan-7-one;3-(6-chloro-1H-indol-4-yl)-3,10-diazaspiro[5.6]dodecan-9-one

8-(6-chloro-1H-indazol-4-yl)-3-(cyclohexylmethyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;8-(6-chloro-1H-indazol-4-yl)-3-[2-(dimethylamino)ethyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione;(1R,5S)-3-(6-chloro-1H-indol-4-yl)-3,6-diazabicyclo[3.2.2]nonan-7-one;3-(6-chloro-1H-indol-4-yl)-3,10-diazaspiro[5.6]dodecan-9-one (PubChem CID 157162653) has the molecular formula C72H87Cl4N17O6 and a molecular weight of 1428.41 g/mol. Its IUPAC name is 8-(6-chloro-1H-indazol-4-yl)-3-(cyclohexylmethyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;8-(6-chloro-1H-indazol-4-yl)-3-[2-(dimethylamino)ethyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione;(1R,5S)-3-(6-chloro-1H-indol-4-yl)-3,6-diazabicyclo[3.2.2]nonan-7-one;3-(6-chloro-1H-indol-4-yl)-3,10-diazaspiro[5.6]dodecan-9-one.

Molecular Properties

• Compound Name: 8-(6-chloro-1H-indazol-4-yl)-3-(cyclohexylmethyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;8-(6-chloro-1H-indazol-4-yl)-3-[2-(dimethylamino)ethyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione;(1R,5S)-3-(6-chloro-1H-indol-4-yl)-3,6-diazabicyclo[3.2.2]nonan-7-one;3-(6-chloro-1H-indol-4-yl)-3,10-diazaspiro[5.6]dodecan-9-one
• PubChem CID: 157162653
• Molecular Formula: C72H87Cl4N17O6
• Molecular Weight: 1428.41 g/mol
• Exact Mass: 1425.58
• IUPAC Name: 8-(6-chloro-1H-indazol-4-yl)-3-(cyclohexylmethyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;8-(6-chloro-1H-indazol-4-yl)-3-[2-(dimethylamino)ethyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione;(1R,5S)-3-(6-chloro-1H-indol-4-yl)-3,6-diazabicyclo[3.2.2]nonan-7-one;3-(6-chloro-1H-indol-4-yl)-3,10-diazaspiro[5.6]dodecan-9-one
• SMILES: CN(C)CCN1C(=O)NC2(CCN(c3cc(Cl)cc4[nH]ncc34)CC2)C1=O.O=C1CCC2(CCN1)CCN(c1cc(Cl)cc3[nH]ccc13)CC2.O=C1NC2(CCN(c3cc(Cl)cc4[nH]ncc34)CC2)C(=O)N1CC1CCCCC1.O=C1N[C@H]2CC[C@@H]1CN(c1cc(Cl)cc3[nH]ccc13)C2
• InChI: InChI=1S/C21H26ClN5O2.C18H23ClN6O2.C18H22ClN3O.C15H16ClN3O/c22-15-10-17-16(12-23-25-17)18(11-15)26-8-6-21(7-9-26)19(28)27(20(29)24-21)13-14-4-2-1-3-5-14;1-23(2)7-8-25-16(26)18(21-17(25)27)3-5-24(6-4-18)15-10-12(19)9-14-13(15)11-20-22-14;19-13-11-15-14(2-7-20-15)16(12-13)22-9-5-18(6-10-22)3-1-17(23)21-8-4-18;16-10-5-13-12(3-4-17-13)14(6-10)19-7-9-1-2-11(8-19)18-15(9)20/h10-12,14H,1-9,13H2,(H,23,25)(H,24,29);9-11H,3-8H2,1-2H3,(H,20,22)(H,21,27);2,7,11-12,20H,1,3-6,8-10H2,(H,21,23);3-6,9,11,17H,1-2,7-8H2,(H,18,20)/t;;;9-,11+/m...1/s1
• InChIKey: AMNZJRMZZJQKEQ-UOSPXZSUSA-N
• XLogP: 11.60
• TPSA: 262.16 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 13
• Rotatable Bonds: 9
• Heavy Atoms: 99
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1428.41
LogP ≤ 5	11.60
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	13

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'hydantoin', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 8-(6-chloro-1H-indazol-4-yl)-3-(cyclohexylmethyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;8-(6-chloro-1H-indazol-4-yl)-3-[2-(dimethylamino)ethyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione;(1R,5S)-3-(6-chloro-1H-indol-4-yl)-3,6-diazabicyclo[3.2.2]nonan-7-one;3-(6-chloro-1H-indol-4-yl)-3,10-diazaspiro[5.6]dodecan-9-one?

The IUPAC name of 8-(6-chloro-1H-indazol-4-yl)-3-(cyclohexylmethyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;8-(6-chloro-1H-indazol-4-yl)-3-[2-(dimethylamino)ethyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione;(1R,5S)-3-(6-chloro-1H-indol-4-yl)-3,6-diazabicyclo[3.2.2]nonan-7-one;3-(6-chloro-1H-indol-4-yl)-3,10-diazaspiro[5.6]dodecan-9-one (CID 157162653) is 8-(6-chloro-1H-indazol-4-yl)-3-(cyclohexylmethyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;8-(6-chloro-1H-indazol-4-yl)-3-[2-(dimethylamino)ethyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione;(1R,5S)-3-(6-chloro-1H-indol-4-yl)-3,6-diazabicyclo[3.2.2]nonan-7-one;3-(6-chloro-1H-indol-4-yl)-3,10-diazaspiro[5.6]dodecan-9-one.

What is the SMILES notation for 8-(6-chloro-1H-indazol-4-yl)-3-(cyclohexylmethyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;8-(6-chloro-1H-indazol-4-yl)-3-[2-(dimethylamino)ethyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione;(1R,5S)-3-(6-chloro-1H-indol-4-yl)-3,6-diazabicyclo[3.2.2]nonan-7-one;3-(6-chloro-1H-indol-4-yl)-3,10-diazaspiro[5.6]dodecan-9-one?

The canonical SMILES for 8-(6-chloro-1H-indazol-4-yl)-3-(cyclohexylmethyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;8-(6-chloro-1H-indazol-4-yl)-3-[2-(dimethylamino)ethyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione;(1R,5S)-3-(6-chloro-1H-indol-4-yl)-3,6-diazabicyclo[3.2.2]nonan-7-one;3-(6-chloro-1H-indol-4-yl)-3,10-diazaspiro[5.6]dodecan-9-one is CN(C)CCN1C(=O)NC2(CCN(c3cc(Cl)cc4[nH]ncc34)CC2)C1=O.O=C1CCC2(CCN1)CCN(c1cc(Cl)cc3[nH]ccc13)CC2.O=C1NC2(CCN(c3cc(Cl)cc4[nH]ncc34)CC2)C(=O)N1CC1CCCCC1.O=C1N[C@H]2CC[C@@H]1CN(c1cc(Cl)cc3[nH]ccc13)C2.

What is the InChIKey of 8-(6-chloro-1H-indazol-4-yl)-3-(cyclohexylmethyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;8-(6-chloro-1H-indazol-4-yl)-3-[2-(dimethylamino)ethyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione;(1R,5S)-3-(6-chloro-1H-indol-4-yl)-3,6-diazabicyclo[3.2.2]nonan-7-one;3-(6-chloro-1H-indol-4-yl)-3,10-diazaspiro[5.6]dodecan-9-one?

The InChIKey is AMNZJRMZZJQKEQ-UOSPXZSUSA-N. The full InChI is InChI=1S/C21H26ClN5O2.C18H23ClN6O2.C18H22ClN3O.C15H16ClN3O/c22-15-10-17-16(12-23-25-17)18(11-15)26-8-6-21(7-9-26)19(28)27(20(29)24-21)13-14-4-2-1-3-5-14;1-23(2)7-8-25-16(26)18(21-17(25)27)3-5-24(6-4-18)15-10-12(19)9-14-13(15)11-20-22-14;19-13-11-15-14(2-7-20-15)16(12-13)22-9-5-18(6-10-22)3-1-17(23)21-8-4-18;16-10-5-13-12(3-4-17-13)14(6-10)19-7-9-1-2-11(8-19)18-15(9)20/h10-12,14H,1-9,13H2,(H,23,25)(H,24,29);9-11H,3-8H2,1-2H3,(H,20,22)(H,21,27);2,7,11-12,20H,1,3-6,8-10H2,(H,21,23);3-6,9,11,17H,1-2,7-8H2,(H,18,20)/t;;;9-,11+/m...1/s1.

What are the key properties of 8-(6-chloro-1H-indazol-4-yl)-3-(cyclohexylmethyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;8-(6-chloro-1H-indazol-4-yl)-3-[2-(dimethylamino)ethyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione;(1R,5S)-3-(6-chloro-1H-indol-4-yl)-3,6-diazabicyclo[3.2.2]nonan-7-one;3-(6-chloro-1H-indol-4-yl)-3,10-diazaspiro[5.6]dodecan-9-one?

8-(6-chloro-1H-indazol-4-yl)-3-(cyclohexylmethyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;8-(6-chloro-1H-indazol-4-yl)-3-[2-(dimethylamino)ethyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione;(1R,5S)-3-(6-chloro-1H-indol-4-yl)-3,6-diazabicyclo[3.2.2]nonan-7-one;3-(6-chloro-1H-indol-4-yl)-3,10-diazaspiro[5.6]dodecan-9-one has a molecular weight of 1428.41 g/mol, XLogP of 11.60, 9 rotatable bonds, 8 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for 8-(6-chloro-1H-indazol-4-yl)-3-(cyclohexylmethyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;8-(6-chloro-1H-indazol-4-yl)-3-[2-(dimethylamino)ethyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione;(1R,5S)-3-(6-chloro-1H-indol-4-yl)-3,6-diazabicyclo[3.2.2]nonan-7-one;3-(6-chloro-1H-indol-4-yl)-3,10-diazaspiro[5.6]dodecan-9-one is sourced from PubChem (CID 157162653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).