sodium;N,N-di(ethyl)propan-2-amine;2-(3,4-dimethoxyphenyl)-4-propan-2-ylpyrimidine;1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;1,3-dimethyl-6-(4-propan-2-yl-2-pyridinyl)pyrrolo[2,3-b]pyridine;1,2-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;1,3-dimethyl-6-propan-2-ylpyrrolo[2,3-b]pyridine;2-methyl-1-[(3S)-1-methylpyrrolidin-3-yl]-6-propan-2-ylbenzimidazole;1-methyl-5-(5-propan-2-ylpyridazin-3-yl)indazole;4-propan-2-yl-2H-pyrimidin-2-ide

C115H150N21NaO2-2 — CID 157290626

About sodium;N,N-di(ethyl)propan-2-amine;2-(3,4-dimethoxyphenyl)-4-propan-2-ylpyrimidine;1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;1,3-dimethyl-6-(4-propan-2-yl-2-pyridinyl)pyrrolo[2,3-b]pyridine;1,2-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;1,3-dimethyl-6-propan-2-ylpyrrolo[2,3-b]pyridine;2-methyl-1-[(3S)-1-methylpyrrolidin-3-yl]-6-propan-2-ylbenzimidazole;1-methyl-5-(5-propan-2-ylpyridazin-3-yl)indazole;4-propan-2-yl-2H-pyrimidin-2-ide

sodium;N,N-di(ethyl)propan-2-amine;2-(3,4-dimethoxyphenyl)-4-propan-2-ylpyrimidine;1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;1,3-dimethyl-6-(4-propan-2-yl-2-pyridinyl)pyrrolo[2,3-b]pyridine;1,2-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;1,3-dimethyl-6-propan-2-ylpyrrolo[2,3-b]pyridine;2-methyl-1-[(3S)-1-methylpyrrolidin-3-yl]-6-propan-2-ylbenzimidazole;1-methyl-5-(5-propan-2-ylpyridazin-3-yl)indazole;4-propan-2-yl-2H-pyrimidin-2-ide (PubChem CID 157290626) has the molecular formula C115H150N21NaO2-2 and a molecular weight of 1881.60 g/mol. Its IUPAC name is sodium;N,N-di(ethyl)propan-2-amine;2-(3,4-dimethoxyphenyl)-4-propan-2-ylpyrimidine;1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;1,3-dimethyl-6-(4-propan-2-yl-2-pyridinyl)pyrrolo[2,3-b]pyridine;1,2-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;1,3-dimethyl-6-propan-2-ylpyrrolo[2,3-b]pyridine;2-methyl-1-[(3S)-1-methylpyrrolidin-3-yl]-6-propan-2-ylbenzimidazole;1-methyl-5-(5-propan-2-ylpyridazin-3-yl)indazole;4-propan-2-yl-2H-pyrimidin-2-ide.

Molecular Properties

• Compound Name: sodium;N,N-di(ethyl)propan-2-amine;2-(3,4-dimethoxyphenyl)-4-propan-2-ylpyrimidine;1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;1,3-dimethyl-6-(4-propan-2-yl-2-pyridinyl)pyrrolo[2,3-b]pyridine;1,2-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;1,3-dimethyl-6-propan-2-ylpyrrolo[2,3-b]pyridine;2-methyl-1-[(3S)-1-methylpyrrolidin-3-yl]-6-propan-2-ylbenzimidazole;1-methyl-5-(5-propan-2-ylpyridazin-3-yl)indazole;4-propan-2-yl-2H-pyrimidin-2-ide
• PubChem CID: 157290626
• Molecular Formula: C115H150N21NaO2-2
• Molecular Weight: 1881.60 g/mol
• Exact Mass: 1880.22
• IUPAC Name: sodium;N,N-di(ethyl)propan-2-amine;2-(3,4-dimethoxyphenyl)-4-propan-2-ylpyrimidine;1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;1,3-dimethyl-6-(4-propan-2-yl-2-pyridinyl)pyrrolo[2,3-b]pyridine;1,2-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;1,3-dimethyl-6-propan-2-ylpyrrolo[2,3-b]pyridine;2-methyl-1-[(3S)-1-methylpyrrolidin-3-yl]-6-propan-2-ylbenzimidazole;1-methyl-5-(5-propan-2-ylpyridazin-3-yl)indazole;4-propan-2-yl-2H-pyrimidin-2-ide
• SMILES: CC(C)c1ccn[c-]n1.CC(C)c1cnnc(-c2ccc3c(cnn3C)c2)c1.COc1ccc(-c2nccc(C(C)C)n2)cc1OC.Cc1c(-c2ccc(C(C)C)cc2)cnn1C.Cc1cc2cc(C(C)C)cnc2n1C.Cc1cn(C)c2nc(-c3cc(C(C)C)ccn3)ccc12.Cc1cn(C)c2nc(C(C)C)ccc12.Cc1nc2ccc(C(C)C)cc2n1[C@H]1CCN(C)C1.[CH2-]CN(C[CH2-])C(C)C.[Na+]
• InChI: InChI=1S/C17H19N3.C16H23N3.C15H16N4.C15H18N2O2.C14H18N2.2C12H16N2.C7H9N2.C7H15N.Na/c1-11(2)13-7-8-18-16(9-13)15-6-5-14-12(3)10-20(4)17(14)19-15;1-11(2)13-5-6-15-16(9-13)19(12(3)17-15)14-7-8-18(4)10-14;1-10(2)12-7-14(18-16-8-12)11-4-5-15-13(6-11)9-17-19(15)3;1-10(2)12-7-8-16-15(17-12)11-5-6-13(18-3)14(9-11)19-4;1-10(2)12-5-7-13(8-6-12)14-9-15-16(4)11(14)3;1-8(2)11-6-10-5-9(3)14(4)12(10)13-7-11;1-8(2)11-6-5-10-9(3)7-14(4)12(10)13-11;1-6(2)7-3-4-8-5-9-7;1-5-8(6-2)7(3)4;/h5-11H,1-4H3;5-6,9,11,14H,7-8,10H2,1-4H3;4-10H,1-3H3;5-10H,1-4H3;5-10H,1-4H3;2*5-8H,1-4H3;3-4,6H,1-2H3;7H,1-2,5-6H2,3-4H3;/q;;;;;;;-1;-2;+1/t;14-;;;;;;;;/m.0......../s1
• InChIKey: JQYHEDCQESXYDQ-ZCETVZEPSA-N
• XLogP: 23.15
• TPSA: 222.09 Ų
• H-Bond Acceptors: 23
• Rotatable Bonds: 18
• Heavy Atoms: 139
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1881.60
LogP ≤ 5	23.15
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of sodium;N,N-di(ethyl)propan-2-amine;2-(3,4-dimethoxyphenyl)-4-propan-2-ylpyrimidine;1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;1,3-dimethyl-6-(4-propan-2-yl-2-pyridinyl)pyrrolo[2,3-b]pyridine;1,2-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;1,3-dimethyl-6-propan-2-ylpyrrolo[2,3-b]pyridine;2-methyl-1-[(3S)-1-methylpyrrolidin-3-yl]-6-propan-2-ylbenzimidazole;1-methyl-5-(5-propan-2-ylpyridazin-3-yl)indazole;4-propan-2-yl-2H-pyrimidin-2-ide?

The IUPAC name of sodium;N,N-di(ethyl)propan-2-amine;2-(3,4-dimethoxyphenyl)-4-propan-2-ylpyrimidine;1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;1,3-dimethyl-6-(4-propan-2-yl-2-pyridinyl)pyrrolo[2,3-b]pyridine;1,2-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;1,3-dimethyl-6-propan-2-ylpyrrolo[2,3-b]pyridine;2-methyl-1-[(3S)-1-methylpyrrolidin-3-yl]-6-propan-2-ylbenzimidazole;1-methyl-5-(5-propan-2-ylpyridazin-3-yl)indazole;4-propan-2-yl-2H-pyrimidin-2-ide (CID 157290626) is sodium;N,N-di(ethyl)propan-2-amine;2-(3,4-dimethoxyphenyl)-4-propan-2-ylpyrimidine;1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;1,3-dimethyl-6-(4-propan-2-yl-2-pyridinyl)pyrrolo[2,3-b]pyridine;1,2-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;1,3-dimethyl-6-propan-2-ylpyrrolo[2,3-b]pyridine;2-methyl-1-[(3S)-1-methylpyrrolidin-3-yl]-6-propan-2-ylbenzimidazole;1-methyl-5-(5-propan-2-ylpyridazin-3-yl)indazole;4-propan-2-yl-2H-pyrimidin-2-ide.

What is the SMILES notation for sodium;N,N-di(ethyl)propan-2-amine;2-(3,4-dimethoxyphenyl)-4-propan-2-ylpyrimidine;1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;1,3-dimethyl-6-(4-propan-2-yl-2-pyridinyl)pyrrolo[2,3-b]pyridine;1,2-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;1,3-dimethyl-6-propan-2-ylpyrrolo[2,3-b]pyridine;2-methyl-1-[(3S)-1-methylpyrrolidin-3-yl]-6-propan-2-ylbenzimidazole;1-methyl-5-(5-propan-2-ylpyridazin-3-yl)indazole;4-propan-2-yl-2H-pyrimidin-2-ide?

The canonical SMILES for sodium;N,N-di(ethyl)propan-2-amine;2-(3,4-dimethoxyphenyl)-4-propan-2-ylpyrimidine;1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;1,3-dimethyl-6-(4-propan-2-yl-2-pyridinyl)pyrrolo[2,3-b]pyridine;1,2-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;1,3-dimethyl-6-propan-2-ylpyrrolo[2,3-b]pyridine;2-methyl-1-[(3S)-1-methylpyrrolidin-3-yl]-6-propan-2-ylbenzimidazole;1-methyl-5-(5-propan-2-ylpyridazin-3-yl)indazole;4-propan-2-yl-2H-pyrimidin-2-ide is CC(C)c1ccn[c-]n1.CC(C)c1cnnc(-c2ccc3c(cnn3C)c2)c1.COc1ccc(-c2nccc(C(C)C)n2)cc1OC.Cc1c(-c2ccc(C(C)C)cc2)cnn1C.Cc1cc2cc(C(C)C)cnc2n1C.Cc1cn(C)c2nc(-c3cc(C(C)C)ccn3)ccc12.Cc1cn(C)c2nc(C(C)C)ccc12.Cc1nc2ccc(C(C)C)cc2n1[C@H]1CCN(C)C1.[CH2-]CN(C[CH2-])C(C)C.[Na+].

What is the InChIKey of sodium;N,N-di(ethyl)propan-2-amine;2-(3,4-dimethoxyphenyl)-4-propan-2-ylpyrimidine;1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;1,3-dimethyl-6-(4-propan-2-yl-2-pyridinyl)pyrrolo[2,3-b]pyridine;1,2-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;1,3-dimethyl-6-propan-2-ylpyrrolo[2,3-b]pyridine;2-methyl-1-[(3S)-1-methylpyrrolidin-3-yl]-6-propan-2-ylbenzimidazole;1-methyl-5-(5-propan-2-ylpyridazin-3-yl)indazole;4-propan-2-yl-2H-pyrimidin-2-ide?

The InChIKey is JQYHEDCQESXYDQ-ZCETVZEPSA-N. The full InChI is InChI=1S/C17H19N3.C16H23N3.C15H16N4.C15H18N2O2.C14H18N2.2C12H16N2.C7H9N2.C7H15N.Na/c1-11(2)13-7-8-18-16(9-13)15-6-5-14-12(3)10-20(4)17(14)19-15;1-11(2)13-5-6-15-16(9-13)19(12(3)17-15)14-7-8-18(4)10-14;1-10(2)12-7-14(18-16-8-12)11-4-5-15-13(6-11)9-17-19(15)3;1-10(2)12-7-8-16-15(17-12)11-5-6-13(18-3)14(9-11)19-4;1-10(2)12-5-7-13(8-6-12)14-9-15-16(4)11(14)3;1-8(2)11-6-10-5-9(3)14(4)12(10)13-7-11;1-8(2)11-6-5-10-9(3)7-14(4)12(10)13-11;1-6(2)7-3-4-8-5-9-7;1-5-8(6-2)7(3)4;/h5-11H,1-4H3;5-6,9,11,14H,7-8,10H2,1-4H3;4-10H,1-3H3;5-10H,1-4H3;5-10H,1-4H3;2*5-8H,1-4H3;3-4,6H,1-2H3;7H,1-2,5-6H2,3-4H3;/q;;;;;;;-1;-2;+1/t;14-;;;;;;;;/m.0......../s1.

What are the key properties of sodium;N,N-di(ethyl)propan-2-amine;2-(3,4-dimethoxyphenyl)-4-propan-2-ylpyrimidine;1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;1,3-dimethyl-6-(4-propan-2-yl-2-pyridinyl)pyrrolo[2,3-b]pyridine;1,2-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;1,3-dimethyl-6-propan-2-ylpyrrolo[2,3-b]pyridine;2-methyl-1-[(3S)-1-methylpyrrolidin-3-yl]-6-propan-2-ylbenzimidazole;1-methyl-5-(5-propan-2-ylpyridazin-3-yl)indazole;4-propan-2-yl-2H-pyrimidin-2-ide?

sodium;N,N-di(ethyl)propan-2-amine;2-(3,4-dimethoxyphenyl)-4-propan-2-ylpyrimidine;1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;1,3-dimethyl-6-(4-propan-2-yl-2-pyridinyl)pyrrolo[2,3-b]pyridine;1,2-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;1,3-dimethyl-6-propan-2-ylpyrrolo[2,3-b]pyridine;2-methyl-1-[(3S)-1-methylpyrrolidin-3-yl]-6-propan-2-ylbenzimidazole;1-methyl-5-(5-propan-2-ylpyridazin-3-yl)indazole;4-propan-2-yl-2H-pyrimidin-2-ide has a molecular weight of 1881.60 g/mol, XLogP of 23.15, 18 rotatable bonds, 0 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for sodium;N,N-di(ethyl)propan-2-amine;2-(3,4-dimethoxyphenyl)-4-propan-2-ylpyrimidine;1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;1,3-dimethyl-6-(4-propan-2-yl-2-pyridinyl)pyrrolo[2,3-b]pyridine;1,2-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;1,3-dimethyl-6-propan-2-ylpyrrolo[2,3-b]pyridine;2-methyl-1-[(3S)-1-methylpyrrolidin-3-yl]-6-propan-2-ylbenzimidazole;1-methyl-5-(5-propan-2-ylpyridazin-3-yl)indazole;4-propan-2-yl-2H-pyrimidin-2-ide is sourced from PubChem (CID 157290626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).