methane;1-methylsulfonyl-N-(5-phenylpyrazin-2-yl)spiro[2H-indole-3,4'-piperidine]-1'-carboxamide;1-methylsulfonylspiro[2H-indole-3,4'-piperidine];phenyl N-(5-phenylpyrazin-2-yl)carbamate;5-phenylpyrazin-2-amine;hydrochloride

C66H74ClN13O7S2 — CID 157277880

About methane;1-methylsulfonyl-N-(5-phenylpyrazin-2-yl)spiro[2H-indole-3,4'-piperidine]-1'-carboxamide;1-methylsulfonylspiro[2H-indole-3,4'-piperidine];phenyl N-(5-phenylpyrazin-2-yl)carbamate;5-phenylpyrazin-2-amine;hydrochloride

methane;1-methylsulfonyl-N-(5-phenylpyrazin-2-yl)spiro[2H-indole-3,4'-piperidine]-1'-carboxamide;1-methylsulfonylspiro[2H-indole-3,4'-piperidine];phenyl N-(5-phenylpyrazin-2-yl)carbamate;5-phenylpyrazin-2-amine;hydrochloride (PubChem CID 157277880) has the molecular formula C66H74ClN13O7S2 and a molecular weight of 1260.99 g/mol. Its IUPAC name is methane;1-methylsulfonyl-N-(5-phenylpyrazin-2-yl)spiro[2H-indole-3,4'-piperidine]-1'-carboxamide;1-methylsulfonylspiro[2H-indole-3,4'-piperidine];phenyl N-(5-phenylpyrazin-2-yl)carbamate;5-phenylpyrazin-2-amine;hydrochloride.

Molecular Properties

• Compound Name: methane;1-methylsulfonyl-N-(5-phenylpyrazin-2-yl)spiro[2H-indole-3,4'-piperidine]-1'-carboxamide;1-methylsulfonylspiro[2H-indole-3,4'-piperidine];phenyl N-(5-phenylpyrazin-2-yl)carbamate;5-phenylpyrazin-2-amine;hydrochloride
• PubChem CID: 157277880
• Molecular Formula: C66H74ClN13O7S2
• Molecular Weight: 1260.99 g/mol
• Exact Mass: 1259.50
• IUPAC Name: methane;1-methylsulfonyl-N-(5-phenylpyrazin-2-yl)spiro[2H-indole-3,4'-piperidine]-1'-carboxamide;1-methylsulfonylspiro[2H-indole-3,4'-piperidine];phenyl N-(5-phenylpyrazin-2-yl)carbamate;5-phenylpyrazin-2-amine;hydrochloride
• SMILES: C.C.CS(=O)(=O)N1CC2(CCN(C(=O)Nc3cnc(-c4ccccc4)cn3)CC2)c2ccccc21.CS(=O)(=O)N1CC2(CCNCC2)c2ccccc21.Cl.Nc1cnc(-c2ccccc2)cn1.O=C(Nc1cnc(-c2ccccc2)cn1)Oc1ccccc1
• InChI: InChI=1S/C24H25N5O3S.C17H13N3O2.C13H18N2O2S.C10H9N3.2CH4.ClH/c1-33(31,32)29-17-24(19-9-5-6-10-21(19)29)11-13-28(14-12-24)23(30)27-22-16-25-20(15-26-22)18-7-3-2-4-8-18;21-17(22-14-9-5-2-6-10-14)20-16-12-18-15(11-19-16)13-7-3-1-4-8-13;1-18(16,17)15-10-13(6-8-14-9-7-13)11-4-2-3-5-12(11)15;11-10-7-12-9(6-13-10)8-4-2-1-3-5-8;;;/h2-10,15-16H,11-14,17H2,1H3,(H,26,27,30);1-12H,(H,19,20,21);2-5,14H,6-10H2,1H3;1-7H,(H2,11,13);2*1H4;1H
• InChIKey: NYEBTKKDZNNKSH-UHFFFAOYSA-N
• XLogP: 11.75
• TPSA: 260.82 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 15
• Rotatable Bonds: 8
• Heavy Atoms: 89
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1260.99
LogP ≤ 5	11.75
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	15

Frequently Asked Questions

What is the IUPAC name of methane;1-methylsulfonyl-N-(5-phenylpyrazin-2-yl)spiro[2H-indole-3,4'-piperidine]-1'-carboxamide;1-methylsulfonylspiro[2H-indole-3,4'-piperidine];phenyl N-(5-phenylpyrazin-2-yl)carbamate;5-phenylpyrazin-2-amine;hydrochloride?

The IUPAC name of methane;1-methylsulfonyl-N-(5-phenylpyrazin-2-yl)spiro[2H-indole-3,4'-piperidine]-1'-carboxamide;1-methylsulfonylspiro[2H-indole-3,4'-piperidine];phenyl N-(5-phenylpyrazin-2-yl)carbamate;5-phenylpyrazin-2-amine;hydrochloride (CID 157277880) is methane;1-methylsulfonyl-N-(5-phenylpyrazin-2-yl)spiro[2H-indole-3,4'-piperidine]-1'-carboxamide;1-methylsulfonylspiro[2H-indole-3,4'-piperidine];phenyl N-(5-phenylpyrazin-2-yl)carbamate;5-phenylpyrazin-2-amine;hydrochloride.

What is the SMILES notation for methane;1-methylsulfonyl-N-(5-phenylpyrazin-2-yl)spiro[2H-indole-3,4'-piperidine]-1'-carboxamide;1-methylsulfonylspiro[2H-indole-3,4'-piperidine];phenyl N-(5-phenylpyrazin-2-yl)carbamate;5-phenylpyrazin-2-amine;hydrochloride?

The canonical SMILES for methane;1-methylsulfonyl-N-(5-phenylpyrazin-2-yl)spiro[2H-indole-3,4'-piperidine]-1'-carboxamide;1-methylsulfonylspiro[2H-indole-3,4'-piperidine];phenyl N-(5-phenylpyrazin-2-yl)carbamate;5-phenylpyrazin-2-amine;hydrochloride is C.C.CS(=O)(=O)N1CC2(CCN(C(=O)Nc3cnc(-c4ccccc4)cn3)CC2)c2ccccc21.CS(=O)(=O)N1CC2(CCNCC2)c2ccccc21.Cl.Nc1cnc(-c2ccccc2)cn1.O=C(Nc1cnc(-c2ccccc2)cn1)Oc1ccccc1.

What is the InChIKey of methane;1-methylsulfonyl-N-(5-phenylpyrazin-2-yl)spiro[2H-indole-3,4'-piperidine]-1'-carboxamide;1-methylsulfonylspiro[2H-indole-3,4'-piperidine];phenyl N-(5-phenylpyrazin-2-yl)carbamate;5-phenylpyrazin-2-amine;hydrochloride?

The InChIKey is NYEBTKKDZNNKSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N5O3S.C17H13N3O2.C13H18N2O2S.C10H9N3.2CH4.ClH/c1-33(31,32)29-17-24(19-9-5-6-10-21(19)29)11-13-28(14-12-24)23(30)27-22-16-25-20(15-26-22)18-7-3-2-4-8-18;21-17(22-14-9-5-2-6-10-14)20-16-12-18-15(11-19-16)13-7-3-1-4-8-13;1-18(16,17)15-10-13(6-8-14-9-7-13)11-4-2-3-5-12(11)15;11-10-7-12-9(6-13-10)8-4-2-1-3-5-8;;;/h2-10,15-16H,11-14,17H2,1H3,(H,26,27,30);1-12H,(H,19,20,21);2-5,14H,6-10H2,1H3;1-7H,(H2,11,13);2*1H4;1H.

What are the key properties of methane;1-methylsulfonyl-N-(5-phenylpyrazin-2-yl)spiro[2H-indole-3,4'-piperidine]-1'-carboxamide;1-methylsulfonylspiro[2H-indole-3,4'-piperidine];phenyl N-(5-phenylpyrazin-2-yl)carbamate;5-phenylpyrazin-2-amine;hydrochloride?

methane;1-methylsulfonyl-N-(5-phenylpyrazin-2-yl)spiro[2H-indole-3,4'-piperidine]-1'-carboxamide;1-methylsulfonylspiro[2H-indole-3,4'-piperidine];phenyl N-(5-phenylpyrazin-2-yl)carbamate;5-phenylpyrazin-2-amine;hydrochloride has a molecular weight of 1260.99 g/mol, XLogP of 11.75, 8 rotatable bonds, 4 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for methane;1-methylsulfonyl-N-(5-phenylpyrazin-2-yl)spiro[2H-indole-3,4'-piperidine]-1'-carboxamide;1-methylsulfonylspiro[2H-indole-3,4'-piperidine];phenyl N-(5-phenylpyrazin-2-yl)carbamate;5-phenylpyrazin-2-amine;hydrochloride is sourced from PubChem (CID 157277880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).