1-[1-[2-[(2,3-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(2,5-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[(2R)-4-[(2-methoxy-4-phenylphenyl)methyl]-2-methylpiperazine-1-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[8-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-2-carbonyl]pyrazol-3-yl]ethanone

C111H132Cl4N20O11 — CID 159372415

About 1-[1-[2-[(2,3-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(2,5-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[(2R)-4-[(2-methoxy-4-phenylphenyl)methyl]-2-methylpiperazine-1-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[8-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-2-carbonyl]pyrazol-3-yl]ethanone

1-[1-[2-[(2,3-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(2,5-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[(2R)-4-[(2-methoxy-4-phenylphenyl)methyl]-2-methylpiperazine-1-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[8-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-2-carbonyl]pyrazol-3-yl]ethanone (PubChem CID 159372415) has the molecular formula C111H132Cl4N20O11 and a molecular weight of 2064.22 g/mol. Its IUPAC name is 1-[1-[2-[(2,3-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(2,5-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[(2R)-4-[(2-methoxy-4-phenylphenyl)methyl]-2-methylpiperazine-1-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[8-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-2-carbonyl]pyrazol-3-yl]ethanone.

Molecular Properties

• Compound Name: 1-[1-[2-[(2,3-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(2,5-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[(2R)-4-[(2-methoxy-4-phenylphenyl)methyl]-2-methylpiperazine-1-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[8-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-2-carbonyl]pyrazol-3-yl]ethanone
• PubChem CID: 159372415
• Molecular Formula: C111H132Cl4N20O11
• Molecular Weight: 2064.22 g/mol
• Exact Mass: 2060.91
• IUPAC Name: 1-[1-[2-[(2,3-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(2,5-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[(2R)-4-[(2-methoxy-4-phenylphenyl)methyl]-2-methylpiperazine-1-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[8-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-2-carbonyl]pyrazol-3-yl]ethanone
• SMILES: CC(=O)c1ccn(C(=O)N2CCC3(CCN(Cc4cc(Cl)ccc4Cl)C3)CC2)n1.CC(=O)c1ccn(C(=O)N2CCC3(CCN(Cc4cccc(C)c4)C3)CC2)n1.CC(=O)c1ccn(C(=O)N2CCC3(CCN(Cc4cccc(C)c4)CC3)C2)n1.CC(=O)c1ccn(C(=O)N2CCC3(CCN(Cc4cccc(Cl)c4Cl)C3)CC2)n1.COc1cc(-c2ccccc2)ccc1CN1CCN(C(=O)n2ccc(C(C)=O)n2)[C@H](C)C1
• InChI: InChI=1S/C25H28N4O3.2C22H28N4O2.2C21H24Cl2N4O2/c1-18-16-27(13-14-28(18)25(31)29-12-11-23(26-29)19(2)30)17-22-10-9-21(15-24(22)32-3)20-7-5-4-6-8-20;1-17-4-3-5-19(14-17)15-24-11-7-22(16-24)8-12-25(13-9-22)21(28)26-10-6-20(23-26)18(2)27;1-17-4-3-5-19(14-17)15-24-11-7-22(8-12-24)9-13-25(16-22)21(28)26-10-6-20(23-26)18(2)27;1-15(28)19-4-8-27(24-19)20(29)26-10-6-21(7-11-26)5-9-25(14-21)13-16-12-17(22)2-3-18(16)23;1-15(28)18-5-9-27(24-18)20(29)26-11-7-21(8-12-26)6-10-25(14-21)13-16-3-2-4-17(22)19(16)23/h4-12,15,18H,13-14,16-17H2,1-3H3;2*3-6,10,14H,7-9,11-13,15-16H2,1-2H3;2-4,8,12H,5-7,9-11,13-14H2,1H3;2-5,9H,6-8,10-14H2,1H3/t18-;;;;/m1..../s1
• InChIKey: LJXFUJXXQZNQRB-HHVPYRKWSA-N
• XLogP: 19.33
• TPSA: 301.43 Ų
• H-Bond Acceptors: 26
• Rotatable Bonds: 17
• Heavy Atoms: 146
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2064.22
LogP ≤ 5	19.33
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	26

Frequently Asked Questions

What is the IUPAC name of 1-[1-[2-[(2,3-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(2,5-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[(2R)-4-[(2-methoxy-4-phenylphenyl)methyl]-2-methylpiperazine-1-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[8-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-2-carbonyl]pyrazol-3-yl]ethanone?

The IUPAC name of 1-[1-[2-[(2,3-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(2,5-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[(2R)-4-[(2-methoxy-4-phenylphenyl)methyl]-2-methylpiperazine-1-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[8-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-2-carbonyl]pyrazol-3-yl]ethanone (CID 159372415) is 1-[1-[2-[(2,3-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(2,5-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[(2R)-4-[(2-methoxy-4-phenylphenyl)methyl]-2-methylpiperazine-1-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[8-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-2-carbonyl]pyrazol-3-yl]ethanone.

What is the SMILES notation for 1-[1-[2-[(2,3-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(2,5-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[(2R)-4-[(2-methoxy-4-phenylphenyl)methyl]-2-methylpiperazine-1-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[8-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-2-carbonyl]pyrazol-3-yl]ethanone?

The canonical SMILES for 1-[1-[2-[(2,3-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(2,5-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[(2R)-4-[(2-methoxy-4-phenylphenyl)methyl]-2-methylpiperazine-1-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[8-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-2-carbonyl]pyrazol-3-yl]ethanone is CC(=O)c1ccn(C(=O)N2CCC3(CCN(Cc4cc(Cl)ccc4Cl)C3)CC2)n1.CC(=O)c1ccn(C(=O)N2CCC3(CCN(Cc4cccc(C)c4)C3)CC2)n1.CC(=O)c1ccn(C(=O)N2CCC3(CCN(Cc4cccc(C)c4)CC3)C2)n1.CC(=O)c1ccn(C(=O)N2CCC3(CCN(Cc4cccc(Cl)c4Cl)C3)CC2)n1.COc1cc(-c2ccccc2)ccc1CN1CCN(C(=O)n2ccc(C(C)=O)n2)[C@H](C)C1.

What is the InChIKey of 1-[1-[2-[(2,3-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(2,5-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[(2R)-4-[(2-methoxy-4-phenylphenyl)methyl]-2-methylpiperazine-1-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[8-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-2-carbonyl]pyrazol-3-yl]ethanone?

The InChIKey is LJXFUJXXQZNQRB-HHVPYRKWSA-N. The full InChI is InChI=1S/C25H28N4O3.2C22H28N4O2.2C21H24Cl2N4O2/c1-18-16-27(13-14-28(18)25(31)29-12-11-23(26-29)19(2)30)17-22-10-9-21(15-24(22)32-3)20-7-5-4-6-8-20;1-17-4-3-5-19(14-17)15-24-11-7-22(16-24)8-12-25(13-9-22)21(28)26-10-6-20(23-26)18(2)27;1-17-4-3-5-19(14-17)15-24-11-7-22(8-12-24)9-13-25(16-22)21(28)26-10-6-20(23-26)18(2)27;1-15(28)19-4-8-27(24-19)20(29)26-10-6-21(7-11-26)5-9-25(14-21)13-16-12-17(22)2-3-18(16)23;1-15(28)18-5-9-27(24-18)20(29)26-11-7-21(8-12-26)6-10-25(14-21)13-16-3-2-4-17(22)19(16)23/h4-12,15,18H,13-14,16-17H2,1-3H3;2*3-6,10,14H,7-9,11-13,15-16H2,1-2H3;2-4,8,12H,5-7,9-11,13-14H2,1H3;2-5,9H,6-8,10-14H2,1H3/t18-;;;;/m1..../s1.

What are the key properties of 1-[1-[2-[(2,3-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(2,5-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[(2R)-4-[(2-methoxy-4-phenylphenyl)methyl]-2-methylpiperazine-1-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[8-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-2-carbonyl]pyrazol-3-yl]ethanone?

1-[1-[2-[(2,3-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(2,5-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[(2R)-4-[(2-methoxy-4-phenylphenyl)methyl]-2-methylpiperazine-1-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[8-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-2-carbonyl]pyrazol-3-yl]ethanone has a molecular weight of 2064.22 g/mol, XLogP of 19.33, 17 rotatable bonds, 0 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[1-[2-[(2,3-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(2,5-dichlorophenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[(2R)-4-[(2-methoxy-4-phenylphenyl)methyl]-2-methylpiperazine-1-carbonyl]pyrazol-3-yl]ethanone;1-[1-[2-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrazol-3-yl]ethanone;1-[1-[8-[(3-methylphenyl)methyl]-2,8-diazaspiro[4.5]decane-2-carbonyl]pyrazol-3-yl]ethanone is sourced from PubChem (CID 159372415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).