8-[2-amino-3-chloro-5-(1-methylindazol-5-yl)-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;8-[2-[bis[(4-methoxyphenyl)methyl]amino]-5-bromo-3-chloro-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;5-bromo-3,4-dichloro-N,N-bis[(4-methoxyphenyl)methyl]pyridin-2-amine;tert-butyl 1-oxo-2,8-diazaspiro[4.5]decane-8-carboxylate;(1-methylindazol-5-yl)boronic acid

C92H105BBr2Cl4N16O11 — CID 159258528

About 8-[2-amino-3-chloro-5-(1-methylindazol-5-yl)-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;8-[2-[bis[(4-methoxyphenyl)methyl]amino]-5-bromo-3-chloro-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;5-bromo-3,4-dichloro-N,N-bis[(4-methoxyphenyl)methyl]pyridin-2-amine;tert-butyl 1-oxo-2,8-diazaspiro[4.5]decane-8-carboxylate;(1-methylindazol-5-yl)boronic acid

8-[2-amino-3-chloro-5-(1-methylindazol-5-yl)-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;8-[2-[bis[(4-methoxyphenyl)methyl]amino]-5-bromo-3-chloro-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;5-bromo-3,4-dichloro-N,N-bis[(4-methoxyphenyl)methyl]pyridin-2-amine;tert-butyl 1-oxo-2,8-diazaspiro[4.5]decane-8-carboxylate;(1-methylindazol-5-yl)boronic acid (PubChem CID 159258528) has the molecular formula C92H105BBr2Cl4N16O11 and a molecular weight of 1923.38 g/mol. Its IUPAC name is 8-[2-amino-3-chloro-5-(1-methylindazol-5-yl)-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;8-[2-[bis[(4-methoxyphenyl)methyl]amino]-5-bromo-3-chloro-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;5-bromo-3,4-dichloro-N,N-bis[(4-methoxyphenyl)methyl]pyridin-2-amine;tert-butyl 1-oxo-2,8-diazaspiro[4.5]decane-8-carboxylate;(1-methylindazol-5-yl)boronic acid.

Molecular Properties

• Compound Name: 8-[2-amino-3-chloro-5-(1-methylindazol-5-yl)-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;8-[2-[bis[(4-methoxyphenyl)methyl]amino]-5-bromo-3-chloro-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;5-bromo-3,4-dichloro-N,N-bis[(4-methoxyphenyl)methyl]pyridin-2-amine;tert-butyl 1-oxo-2,8-diazaspiro[4.5]decane-8-carboxylate;(1-methylindazol-5-yl)boronic acid
• PubChem CID: 159258528
• Molecular Formula: C92H105BBr2Cl4N16O11
• Molecular Weight: 1923.38 g/mol
• Exact Mass: 1918.54
• IUPAC Name: 8-[2-amino-3-chloro-5-(1-methylindazol-5-yl)-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;8-[2-[bis[(4-methoxyphenyl)methyl]amino]-5-bromo-3-chloro-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;5-bromo-3,4-dichloro-N,N-bis[(4-methoxyphenyl)methyl]pyridin-2-amine;tert-butyl 1-oxo-2,8-diazaspiro[4.5]decane-8-carboxylate;(1-methylindazol-5-yl)boronic acid
• SMILES: CC(C)(C)OC(=O)N1CCC2(CCNC2=O)CC1.COc1ccc(CN(Cc2ccc(OC)cc2)c2ncc(Br)c(Cl)c2Cl)cc1.COc1ccc(CN(Cc2ccc(OC)cc2)c2ncc(Br)c(N3CCC4(CCNC4=O)CC3)c2Cl)cc1.Cn1ncc2cc(-c3cnc(N)c(Cl)c3N3CCC4(CCNC4=O)CC3)ccc21.Cn1ncc2cc(B(O)O)ccc21
• InChI: InChI=1S/C29H32BrClN4O3.C21H19BrCl2N2O2.C21H23ClN6O.C13H22N2O3.C8H9BN2O2/c1-37-22-7-3-20(4-8-22)18-35(19-21-5-9-23(38-2)10-6-21)27-25(31)26(24(30)17-33-27)34-15-12-29(13-16-34)11-14-32-28(29)36;1-27-16-7-3-14(4-8-16)12-26(13-15-5-9-17(28-2)10-6-15)21-20(24)19(23)18(22)11-25-21;1-27-16-3-2-13(10-14(16)11-26-27)15-12-25-19(23)17(22)18(15)28-8-5-21(6-9-28)4-7-24-20(21)29;1-12(2,3)18-11(17)15-8-5-13(6-9-15)4-7-14-10(13)16;1-11-8-3-2-7(9(12)13)4-6(8)5-10-11/h3-10,17H,11-16,18-19H2,1-2H3,(H,32,36);3-11H,12-13H2,1-2H3;2-3,10-12H,4-9H2,1H3,(H2,23,25)(H,24,29);4-9H2,1-3H3,(H,14,16);2-5,12-13H,1H3
• InChIKey: KWFCNGYTLVZTDJ-UHFFFAOYSA-N
• XLogP: 15.96
• TPSA: 307.51 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 23
• Rotatable Bonds: 18
• Heavy Atoms: 126
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1923.38
LogP ≤ 5	15.96
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 8-[2-amino-3-chloro-5-(1-methylindazol-5-yl)-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;8-[2-[bis[(4-methoxyphenyl)methyl]amino]-5-bromo-3-chloro-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;5-bromo-3,4-dichloro-N,N-bis[(4-methoxyphenyl)methyl]pyridin-2-amine;tert-butyl 1-oxo-2,8-diazaspiro[4.5]decane-8-carboxylate;(1-methylindazol-5-yl)boronic acid?

The IUPAC name of 8-[2-amino-3-chloro-5-(1-methylindazol-5-yl)-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;8-[2-[bis[(4-methoxyphenyl)methyl]amino]-5-bromo-3-chloro-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;5-bromo-3,4-dichloro-N,N-bis[(4-methoxyphenyl)methyl]pyridin-2-amine;tert-butyl 1-oxo-2,8-diazaspiro[4.5]decane-8-carboxylate;(1-methylindazol-5-yl)boronic acid (CID 159258528) is 8-[2-amino-3-chloro-5-(1-methylindazol-5-yl)-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;8-[2-[bis[(4-methoxyphenyl)methyl]amino]-5-bromo-3-chloro-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;5-bromo-3,4-dichloro-N,N-bis[(4-methoxyphenyl)methyl]pyridin-2-amine;tert-butyl 1-oxo-2,8-diazaspiro[4.5]decane-8-carboxylate;(1-methylindazol-5-yl)boronic acid.

What is the SMILES notation for 8-[2-amino-3-chloro-5-(1-methylindazol-5-yl)-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;8-[2-[bis[(4-methoxyphenyl)methyl]amino]-5-bromo-3-chloro-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;5-bromo-3,4-dichloro-N,N-bis[(4-methoxyphenyl)methyl]pyridin-2-amine;tert-butyl 1-oxo-2,8-diazaspiro[4.5]decane-8-carboxylate;(1-methylindazol-5-yl)boronic acid?

The canonical SMILES for 8-[2-amino-3-chloro-5-(1-methylindazol-5-yl)-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;8-[2-[bis[(4-methoxyphenyl)methyl]amino]-5-bromo-3-chloro-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;5-bromo-3,4-dichloro-N,N-bis[(4-methoxyphenyl)methyl]pyridin-2-amine;tert-butyl 1-oxo-2,8-diazaspiro[4.5]decane-8-carboxylate;(1-methylindazol-5-yl)boronic acid is CC(C)(C)OC(=O)N1CCC2(CCNC2=O)CC1.COc1ccc(CN(Cc2ccc(OC)cc2)c2ncc(Br)c(Cl)c2Cl)cc1.COc1ccc(CN(Cc2ccc(OC)cc2)c2ncc(Br)c(N3CCC4(CCNC4=O)CC3)c2Cl)cc1.Cn1ncc2cc(-c3cnc(N)c(Cl)c3N3CCC4(CCNC4=O)CC3)ccc21.Cn1ncc2cc(B(O)O)ccc21.

What is the InChIKey of 8-[2-amino-3-chloro-5-(1-methylindazol-5-yl)-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;8-[2-[bis[(4-methoxyphenyl)methyl]amino]-5-bromo-3-chloro-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;5-bromo-3,4-dichloro-N,N-bis[(4-methoxyphenyl)methyl]pyridin-2-amine;tert-butyl 1-oxo-2,8-diazaspiro[4.5]decane-8-carboxylate;(1-methylindazol-5-yl)boronic acid?

The InChIKey is KWFCNGYTLVZTDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H32BrClN4O3.C21H19BrCl2N2O2.C21H23ClN6O.C13H22N2O3.C8H9BN2O2/c1-37-22-7-3-20(4-8-22)18-35(19-21-5-9-23(38-2)10-6-21)27-25(31)26(24(30)17-33-27)34-15-12-29(13-16-34)11-14-32-28(29)36;1-27-16-7-3-14(4-8-16)12-26(13-15-5-9-17(28-2)10-6-15)21-20(24)19(23)18(22)11-25-21;1-27-16-3-2-13(10-14(16)11-26-27)15-12-25-19(23)17(22)18(15)28-8-5-21(6-9-28)4-7-24-20(21)29;1-12(2,3)18-11(17)15-8-5-13(6-9-15)4-7-14-10(13)16;1-11-8-3-2-7(9(12)13)4-6(8)5-10-11/h3-10,17H,11-16,18-19H2,1-2H3,(H,32,36);3-11H,12-13H2,1-2H3;2-3,10-12H,4-9H2,1H3,(H2,23,25)(H,24,29);4-9H2,1-3H3,(H,14,16);2-5,12-13H,1H3.

What are the key properties of 8-[2-amino-3-chloro-5-(1-methylindazol-5-yl)-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;8-[2-[bis[(4-methoxyphenyl)methyl]amino]-5-bromo-3-chloro-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;5-bromo-3,4-dichloro-N,N-bis[(4-methoxyphenyl)methyl]pyridin-2-amine;tert-butyl 1-oxo-2,8-diazaspiro[4.5]decane-8-carboxylate;(1-methylindazol-5-yl)boronic acid?

8-[2-amino-3-chloro-5-(1-methylindazol-5-yl)-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;8-[2-[bis[(4-methoxyphenyl)methyl]amino]-5-bromo-3-chloro-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;5-bromo-3,4-dichloro-N,N-bis[(4-methoxyphenyl)methyl]pyridin-2-amine;tert-butyl 1-oxo-2,8-diazaspiro[4.5]decane-8-carboxylate;(1-methylindazol-5-yl)boronic acid has a molecular weight of 1923.38 g/mol, XLogP of 15.96, 18 rotatable bonds, 6 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for 8-[2-amino-3-chloro-5-(1-methylindazol-5-yl)-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;8-[2-[bis[(4-methoxyphenyl)methyl]amino]-5-bromo-3-chloro-4-pyridinyl]-2,8-diazaspiro[4.5]decan-1-one;5-bromo-3,4-dichloro-N,N-bis[(4-methoxyphenyl)methyl]pyridin-2-amine;tert-butyl 1-oxo-2,8-diazaspiro[4.5]decane-8-carboxylate;(1-methylindazol-5-yl)boronic acid is sourced from PubChem (CID 159258528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).