dichloromethane;2,2-dimethyl-N-[2-[10,15,20-tris[2-(2,2-dimethylpropanoylamino)phenyl]porphyrin-5,10,15,20-tetraylium-21,22,23,24-tetraid-5-yl]phenyl]propanamide;1-ethylimidazole;manganese

C70H74Cl2MnN10O4 — CID 139166284

About dichloromethane;2,2-dimethyl-N-[2-[10,15,20-tris[2-(2,2-dimethylpropanoylamino)phenyl]porphyrin-5,10,15,20-tetraylium-21,22,23,24-tetraid-5-yl]phenyl]propanamide;1-ethylimidazole;manganese

dichloromethane;2,2-dimethyl-N-[2-[10,15,20-tris[2-(2,2-dimethylpropanoylamino)phenyl]porphyrin-5,10,15,20-tetraylium-21,22,23,24-tetraid-5-yl]phenyl]propanamide;1-ethylimidazole;manganese (PubChem CID 139166284) has the molecular formula C70H74Cl2MnN10O4 and a molecular weight of 1245.27 g/mol. Its IUPAC name is dichloromethane;2,2-dimethyl-N-[2-[10,15,20-tris[2-(2,2-dimethylpropanoylamino)phenyl]porphyrin-5,10,15,20-tetraylium-21,22,23,24-tetraid-5-yl]phenyl]propanamide;1-ethylimidazole;manganese.

Molecular Properties

• Compound Name: dichloromethane;2,2-dimethyl-N-[2-[10,15,20-tris[2-(2,2-dimethylpropanoylamino)phenyl]porphyrin-5,10,15,20-tetraylium-21,22,23,24-tetraid-5-yl]phenyl]propanamide;1-ethylimidazole;manganese
• PubChem CID: 139166284
• Molecular Formula: C70H74Cl2MnN10O4
• Molecular Weight: 1245.27 g/mol
• Exact Mass: 1243.47
• IUPAC Name: dichloromethane;2,2-dimethyl-N-[2-[10,15,20-tris[2-(2,2-dimethylpropanoylamino)phenyl]porphyrin-5,10,15,20-tetraylium-21,22,23,24-tetraid-5-yl]phenyl]propanamide;1-ethylimidazole;manganese
• SMILES: CC(C)(C)C(=O)Nc1ccccc1[C+]1c2ccc([n-]2)[C+](c2ccccc2NC(=O)C(C)(C)C)c2ccc([n-]2)[C+](c2ccccc2NC(=O)C(C)(C)C)c2ccc([n-]2)[C+](c2ccccc2NC(=O)C(C)(C)C)c2ccc1[n-]2.CCn1ccnc1.ClCCl.[Mn]
• InChI: InChI=1S/C64H64N8O4.C5H8N2.CH2Cl2.Mn/c1-61(2,3)57(73)69-41-25-17-13-21-37(41)53-45-29-31-47(65-45)54(38-22-14-18-26-42(38)70-58(74)62(4,5)6)49-33-35-51(67-49)56(40-24-16-20-28-44(40)72-60(76)64(10,11)12)52-36-34-50(68-52)55(48-32-30-46(53)66-48)39-23-15-19-27-43(39)71-59(75)63(7,8)9;1-2-7-4-3-6-5-7;2-1-3;/h13-36H,1-12H3,(H,69,73)(H,70,74)(H,71,75)(H,72,76);3-5H,2H2,1H3;1H2
• InChIKey: NHYIVALUVQLUDX-UHFFFAOYSA-N
• XLogP: 14.17
• TPSA: 190.62 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 6
• Rotatable Bonds: 9
• Heavy Atoms: 87
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1245.27
LogP ≤ 5	14.17
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of dichloromethane;2,2-dimethyl-N-[2-[10,15,20-tris[2-(2,2-dimethylpropanoylamino)phenyl]porphyrin-5,10,15,20-tetraylium-21,22,23,24-tetraid-5-yl]phenyl]propanamide;1-ethylimidazole;manganese?

The IUPAC name of dichloromethane;2,2-dimethyl-N-[2-[10,15,20-tris[2-(2,2-dimethylpropanoylamino)phenyl]porphyrin-5,10,15,20-tetraylium-21,22,23,24-tetraid-5-yl]phenyl]propanamide;1-ethylimidazole;manganese (CID 139166284) is dichloromethane;2,2-dimethyl-N-[2-[10,15,20-tris[2-(2,2-dimethylpropanoylamino)phenyl]porphyrin-5,10,15,20-tetraylium-21,22,23,24-tetraid-5-yl]phenyl]propanamide;1-ethylimidazole;manganese.

What is the SMILES notation for dichloromethane;2,2-dimethyl-N-[2-[10,15,20-tris[2-(2,2-dimethylpropanoylamino)phenyl]porphyrin-5,10,15,20-tetraylium-21,22,23,24-tetraid-5-yl]phenyl]propanamide;1-ethylimidazole;manganese?

The canonical SMILES for dichloromethane;2,2-dimethyl-N-[2-[10,15,20-tris[2-(2,2-dimethylpropanoylamino)phenyl]porphyrin-5,10,15,20-tetraylium-21,22,23,24-tetraid-5-yl]phenyl]propanamide;1-ethylimidazole;manganese is CC(C)(C)C(=O)Nc1ccccc1[C+]1c2ccc([n-]2)[C+](c2ccccc2NC(=O)C(C)(C)C)c2ccc([n-]2)[C+](c2ccccc2NC(=O)C(C)(C)C)c2ccc([n-]2)[C+](c2ccccc2NC(=O)C(C)(C)C)c2ccc1[n-]2.CCn1ccnc1.ClCCl.[Mn].

What is the InChIKey of dichloromethane;2,2-dimethyl-N-[2-[10,15,20-tris[2-(2,2-dimethylpropanoylamino)phenyl]porphyrin-5,10,15,20-tetraylium-21,22,23,24-tetraid-5-yl]phenyl]propanamide;1-ethylimidazole;manganese?

The InChIKey is NHYIVALUVQLUDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C64H64N8O4.C5H8N2.CH2Cl2.Mn/c1-61(2,3)57(73)69-41-25-17-13-21-37(41)53-45-29-31-47(65-45)54(38-22-14-18-26-42(38)70-58(74)62(4,5)6)49-33-35-51(67-49)56(40-24-16-20-28-44(40)72-60(76)64(10,11)12)52-36-34-50(68-52)55(48-32-30-46(53)66-48)39-23-15-19-27-43(39)71-59(75)63(7,8)9;1-2-7-4-3-6-5-7;2-1-3;/h13-36H,1-12H3,(H,69,73)(H,70,74)(H,71,75)(H,72,76);3-5H,2H2,1H3;1H2;.

What are the key properties of dichloromethane;2,2-dimethyl-N-[2-[10,15,20-tris[2-(2,2-dimethylpropanoylamino)phenyl]porphyrin-5,10,15,20-tetraylium-21,22,23,24-tetraid-5-yl]phenyl]propanamide;1-ethylimidazole;manganese?

dichloromethane;2,2-dimethyl-N-[2-[10,15,20-tris[2-(2,2-dimethylpropanoylamino)phenyl]porphyrin-5,10,15,20-tetraylium-21,22,23,24-tetraid-5-yl]phenyl]propanamide;1-ethylimidazole;manganese has a molecular weight of 1245.27 g/mol, XLogP of 14.17, 9 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for dichloromethane;2,2-dimethyl-N-[2-[10,15,20-tris[2-(2,2-dimethylpropanoylamino)phenyl]porphyrin-5,10,15,20-tetraylium-21,22,23,24-tetraid-5-yl]phenyl]propanamide;1-ethylimidazole;manganese is sourced from PubChem (CID 139166284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).