N-[5-[(1R)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1R)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide

C82H110N26O8S4 — CID 159967691

About N-[5-[(1R)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1R)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide

N-[5-[(1R)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1R)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide (PubChem CID 159967691) has the molecular formula C82H110N26O8S4 and a molecular weight of 1716.22 g/mol. Its IUPAC name is N-[5-[(1R)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1R)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide.

Molecular Properties

• Compound Name: N-[5-[(1R)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1R)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide
• PubChem CID: 159967691
• Molecular Formula: C82H110N26O8S4
• Molecular Weight: 1716.22 g/mol
• Exact Mass: 1714.79
• IUPAC Name: N-[5-[(1R)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1R)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide
• SMILES: CC(=O)Nc1ncc([C@@H](C)N2CCC3(CC2)CN(c2cc(C)nc(C)c2)C(=O)N3)s1.CC(=O)Nc1ncc([C@@H](C)N2CCC3(CC2)CN(c2cc(C)nc(C)n2)C(=O)N3)s1.CC(=O)Nc1ncc([C@H](C)N2CCC3(CC2)CN(c2cc(C)nc(C)c2)C(=O)N3)s1.CC(=O)Nc1ncc([C@H](C)N2CCC3(CC2)CN(c2cc(C)nc(C)n2)C(=O)N3)s1
• InChI: InChI=1S/2C21H28N6O2S.2C20H27N7O2S/c2*1-13-9-17(10-14(2)23-13)27-12-21(25-20(27)29)5-7-26(8-6-21)15(3)18-11-22-19(30-18)24-16(4)28;2*1-12-9-17(23-14(3)22-12)27-11-20(25-19(27)29)5-7-26(8-6-20)13(2)16-10-21-18(30-16)24-15(4)28/h2*9-11,15H,5-8,12H2,1-4H3,(H,25,29)(H,22,24,28);2*9-10,13H,5-8,11H2,1-4H3,(H,25,29)(H,21,24,28)/t2*15-;2*13-/m1010/s1
• InChIKey: OEDJTNCTSHZNKZ-VEZCTOTJSA-N
• XLogP: 11.74
• TPSA: 387.62 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 26
• Rotatable Bonds: 16
• Heavy Atoms: 120
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1716.22
LogP ≤ 5	11.74
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	26

Frequently Asked Questions

What is the IUPAC name of N-[5-[(1R)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1R)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide?

The IUPAC name of N-[5-[(1R)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1R)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide (CID 159967691) is N-[5-[(1R)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1R)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide.

What is the SMILES notation for N-[5-[(1R)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1R)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide?

The canonical SMILES for N-[5-[(1R)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1R)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide is CC(=O)Nc1ncc([C@@H](C)N2CCC3(CC2)CN(c2cc(C)nc(C)c2)C(=O)N3)s1.CC(=O)Nc1ncc([C@@H](C)N2CCC3(CC2)CN(c2cc(C)nc(C)n2)C(=O)N3)s1.CC(=O)Nc1ncc([C@H](C)N2CCC3(CC2)CN(c2cc(C)nc(C)c2)C(=O)N3)s1.CC(=O)Nc1ncc([C@H](C)N2CCC3(CC2)CN(c2cc(C)nc(C)n2)C(=O)N3)s1.

What is the InChIKey of N-[5-[(1R)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1R)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide?

The InChIKey is OEDJTNCTSHZNKZ-VEZCTOTJSA-N. The full InChI is InChI=1S/2C21H28N6O2S.2C20H27N7O2S/c2*1-13-9-17(10-14(2)23-13)27-12-21(25-20(27)29)5-7-26(8-6-21)15(3)18-11-22-19(30-18)24-16(4)28;2*1-12-9-17(23-14(3)22-12)27-11-20(25-19(27)29)5-7-26(8-6-20)13(2)16-10-21-18(30-16)24-15(4)28/h2*9-11,15H,5-8,12H2,1-4H3,(H,25,29)(H,22,24,28);2*9-10,13H,5-8,11H2,1-4H3,(H,25,29)(H,21,24,28)/t2*15-;2*13-/m1010/s1.

What are the key properties of N-[5-[(1R)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1R)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide?

N-[5-[(1R)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1R)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide has a molecular weight of 1716.22 g/mol, XLogP of 11.74, 16 rotatable bonds, 8 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for N-[5-[(1R)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethyl-4-pyridinyl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1R)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide;N-[5-[(1S)-1-[3-(2,6-dimethylpyrimidin-4-yl)-2-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 159967691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).