potassium;2-[3-(2-aminoethyl)-2-(3,5-dimethylphenyl)-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(E)-1-nitroprop-1-en-2-yl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(Z)-2-nitro-1-(3-pyridin-4-ylpyrrolidin-1-yl)ethenyl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;hydride;methane;2-methyl-1-nitroprop-1-ene;4-pyrrolidin-3-ylpyridine

C106H143KN16O9 — CID 159247252

About potassium;2-[3-(2-aminoethyl)-2-(3,5-dimethylphenyl)-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(E)-1-nitroprop-1-en-2-yl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(Z)-2-nitro-1-(3-pyridin-4-ylpyrrolidin-1-yl)ethenyl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;hydride;methane;2-methyl-1-nitroprop-1-ene;4-pyrrolidin-3-ylpyridine

potassium;2-[3-(2-aminoethyl)-2-(3,5-dimethylphenyl)-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(E)-1-nitroprop-1-en-2-yl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(Z)-2-nitro-1-(3-pyridin-4-ylpyrrolidin-1-yl)ethenyl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;hydride;methane;2-methyl-1-nitroprop-1-ene;4-pyrrolidin-3-ylpyridine (PubChem CID 159247252) has the molecular formula C106H143KN16O9 and a molecular weight of 1824.51 g/mol. Its IUPAC name is potassium;2-[3-(2-aminoethyl)-2-(3,5-dimethylphenyl)-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(E)-1-nitroprop-1-en-2-yl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(Z)-2-nitro-1-(3-pyridin-4-ylpyrrolidin-1-yl)ethenyl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;hydride;methane;2-methyl-1-nitroprop-1-ene;4-pyrrolidin-3-ylpyridine.

Molecular Properties

• Compound Name: potassium;2-[3-(2-aminoethyl)-2-(3,5-dimethylphenyl)-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(E)-1-nitroprop-1-en-2-yl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(Z)-2-nitro-1-(3-pyridin-4-ylpyrrolidin-1-yl)ethenyl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;hydride;methane;2-methyl-1-nitroprop-1-ene;4-pyrrolidin-3-ylpyridine
• PubChem CID: 159247252
• Molecular Formula: C106H143KN16O9
• Molecular Weight: 1824.51 g/mol
• Exact Mass: 1823.09
• IUPAC Name: potassium;2-[3-(2-aminoethyl)-2-(3,5-dimethylphenyl)-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(E)-1-nitroprop-1-en-2-yl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(Z)-2-nitro-1-(3-pyridin-4-ylpyrrolidin-1-yl)ethenyl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;hydride;methane;2-methyl-1-nitroprop-1-ene;4-pyrrolidin-3-ylpyridine
• SMILES: C.CC(C)=C[N+](=O)[O-].CCN(CC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCN)c2c1.CCN(CC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCN/C(=C/[N+](=O)[O-])N3CCC(c4ccncc4)C3)c2c1.CCN(CC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCN/C(C)=C/[N+](=O)[O-])c2c1.[H-].[K+].c1cc(C2CCNC2)ccn1
• InChI: InChI=1S/C37H46N6O3.C29H38N4O3.C26H35N3O.C9H12N2.C4H7NO2.CH4.K.H/c1-7-41(8-2)36(44)37(5,6)30-9-10-33-32(22-30)31(35(40-33)29-20-25(3)19-26(4)21-29)13-17-39-34(24-43(45)46)42-18-14-28(23-42)27-11-15-38-16-12-27;1-8-32(9-2)28(34)29(6,7)23-10-11-26-25(17-23)24(12-13-30-21(5)18-33(35)36)27(31-26)22-15-19(3)14-20(4)16-22;1-7-29(8-2)25(30)26(5,6)20-9-10-23-22(16-20)21(11-12-27)24(28-23)19-14-17(3)13-18(4)15-19;1-4-10-5-2-8(1)9-3-6-11-7-9;1-4(2)3-5(6)7;;;/h9-12,15-16,19-22,24,28,39-40H,7-8,13-14,17-18,23H2,1-6H3;10-11,14-18,30-31H,8-9,12-13H2,1-7H3;9-10,13-16,28H,7-8,11-12,27H2,1-6H3;1-2,4-5,9,11H,3,6-7H2;3H,1-2H3;1H4;;/q;;;;;;+1;-1/b34-24-;21-18+
• InChIKey: FRJMQKGJUROFPY-DZXWBWELSA-N
• XLogP: 17.75
• TPSA: 328.85 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 16
• Rotatable Bonds: 31
• Heavy Atoms: 132
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1824.51
LogP ≤ 5	17.75
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	16

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of potassium;2-[3-(2-aminoethyl)-2-(3,5-dimethylphenyl)-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(E)-1-nitroprop-1-en-2-yl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(Z)-2-nitro-1-(3-pyridin-4-ylpyrrolidin-1-yl)ethenyl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;hydride;methane;2-methyl-1-nitroprop-1-ene;4-pyrrolidin-3-ylpyridine?

The IUPAC name of potassium;2-[3-(2-aminoethyl)-2-(3,5-dimethylphenyl)-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(E)-1-nitroprop-1-en-2-yl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(Z)-2-nitro-1-(3-pyridin-4-ylpyrrolidin-1-yl)ethenyl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;hydride;methane;2-methyl-1-nitroprop-1-ene;4-pyrrolidin-3-ylpyridine (CID 159247252) is potassium;2-[3-(2-aminoethyl)-2-(3,5-dimethylphenyl)-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(E)-1-nitroprop-1-en-2-yl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(Z)-2-nitro-1-(3-pyridin-4-ylpyrrolidin-1-yl)ethenyl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;hydride;methane;2-methyl-1-nitroprop-1-ene;4-pyrrolidin-3-ylpyridine.

What is the SMILES notation for potassium;2-[3-(2-aminoethyl)-2-(3,5-dimethylphenyl)-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(E)-1-nitroprop-1-en-2-yl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(Z)-2-nitro-1-(3-pyridin-4-ylpyrrolidin-1-yl)ethenyl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;hydride;methane;2-methyl-1-nitroprop-1-ene;4-pyrrolidin-3-ylpyridine?

The canonical SMILES for potassium;2-[3-(2-aminoethyl)-2-(3,5-dimethylphenyl)-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(E)-1-nitroprop-1-en-2-yl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(Z)-2-nitro-1-(3-pyridin-4-ylpyrrolidin-1-yl)ethenyl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;hydride;methane;2-methyl-1-nitroprop-1-ene;4-pyrrolidin-3-ylpyridine is C.CC(C)=C[N+](=O)[O-].CCN(CC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCN)c2c1.CCN(CC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCN/C(=C/[N+](=O)[O-])N3CCC(c4ccncc4)C3)c2c1.CCN(CC)C(=O)C(C)(C)c1ccc2[nH]c(-c3cc(C)cc(C)c3)c(CCN/C(C)=C/[N+](=O)[O-])c2c1.[H-].[K+].c1cc(C2CCNC2)ccn1.

What is the InChIKey of potassium;2-[3-(2-aminoethyl)-2-(3,5-dimethylphenyl)-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(E)-1-nitroprop-1-en-2-yl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(Z)-2-nitro-1-(3-pyridin-4-ylpyrrolidin-1-yl)ethenyl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;hydride;methane;2-methyl-1-nitroprop-1-ene;4-pyrrolidin-3-ylpyridine?

The InChIKey is FRJMQKGJUROFPY-DZXWBWELSA-N. The full InChI is InChI=1S/C37H46N6O3.C29H38N4O3.C26H35N3O.C9H12N2.C4H7NO2.CH4.K.H/c1-7-41(8-2)36(44)37(5,6)30-9-10-33-32(22-30)31(35(40-33)29-20-25(3)19-26(4)21-29)13-17-39-34(24-43(45)46)42-18-14-28(23-42)27-11-15-38-16-12-27;1-8-32(9-2)28(34)29(6,7)23-10-11-26-25(17-23)24(12-13-30-21(5)18-33(35)36)27(31-26)22-15-19(3)14-20(4)16-22;1-7-29(8-2)25(30)26(5,6)20-9-10-23-22(16-20)21(11-12-27)24(28-23)19-14-17(3)13-18(4)15-19;1-4-10-5-2-8(1)9-3-6-11-7-9;1-4(2)3-5(6)7;;;/h9-12,15-16,19-22,24,28,39-40H,7-8,13-14,17-18,23H2,1-6H3;10-11,14-18,30-31H,8-9,12-13H2,1-7H3;9-10,13-16,28H,7-8,11-12,27H2,1-6H3;1-2,4-5,9,11H,3,6-7H2;3H,1-2H3;1H4;;/q;;;;;;+1;-1/b34-24-;21-18+;;;;;;.

What are the key properties of potassium;2-[3-(2-aminoethyl)-2-(3,5-dimethylphenyl)-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(E)-1-nitroprop-1-en-2-yl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(Z)-2-nitro-1-(3-pyridin-4-ylpyrrolidin-1-yl)ethenyl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;hydride;methane;2-methyl-1-nitroprop-1-ene;4-pyrrolidin-3-ylpyridine?

potassium;2-[3-(2-aminoethyl)-2-(3,5-dimethylphenyl)-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(E)-1-nitroprop-1-en-2-yl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(Z)-2-nitro-1-(3-pyridin-4-ylpyrrolidin-1-yl)ethenyl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;hydride;methane;2-methyl-1-nitroprop-1-ene;4-pyrrolidin-3-ylpyridine has a molecular weight of 1824.51 g/mol, XLogP of 17.75, 31 rotatable bonds, 7 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for potassium;2-[3-(2-aminoethyl)-2-(3,5-dimethylphenyl)-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(E)-1-nitroprop-1-en-2-yl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;2-[2-(3,5-dimethylphenyl)-3-[2-[[(Z)-2-nitro-1-(3-pyridin-4-ylpyrrolidin-1-yl)ethenyl]amino]ethyl]-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide;hydride;methane;2-methyl-1-nitroprop-1-ene;4-pyrrolidin-3-ylpyridine is sourced from PubChem (CID 159247252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).