[(3S)-4-tert-butylmorpholin-3-yl]methanol;[(3R)-4-tert-butylmorpholin-3-yl]methanol;N,N-dimethyl-2-[(2R)-2-methyl-4-(2-methylpropyl)piperazin-1-yl]acetamide;2,2-dimethyl-1-piperazin-1-ylpropan-1-one;2-[(2R,5S)-4-(2,2-dimethylpropyl)-2,5-dimethylpiperazin-1-yl]-N,N-dimethylacetamide;1-(2,2-dimethylpropyl)piperazine

C64H134N12O7 — CID 161440494

About [(3S)-4-tert-butylmorpholin-3-yl]methanol;[(3R)-4-tert-butylmorpholin-3-yl]methanol;N,N-dimethyl-2-[(2R)-2-methyl-4-(2-methylpropyl)piperazin-1-yl]acetamide;2,2-dimethyl-1-piperazin-1-ylpropan-1-one;2-[(2R,5S)-4-(2,2-dimethylpropyl)-2,5-dimethylpiperazin-1-yl]-N,N-dimethylacetamide;1-(2,2-dimethylpropyl)piperazine

[(3S)-4-tert-butylmorpholin-3-yl]methanol;[(3R)-4-tert-butylmorpholin-3-yl]methanol;N,N-dimethyl-2-[(2R)-2-methyl-4-(2-methylpropyl)piperazin-1-yl]acetamide;2,2-dimethyl-1-piperazin-1-ylpropan-1-one;2-[(2R,5S)-4-(2,2-dimethylpropyl)-2,5-dimethylpiperazin-1-yl]-N,N-dimethylacetamide;1-(2,2-dimethylpropyl)piperazine (PubChem CID 161440494) has the molecular formula C64H134N12O7 and a molecular weight of 1183.85 g/mol. Its IUPAC name is [(3S)-4-tert-butylmorpholin-3-yl]methanol;[(3R)-4-tert-butylmorpholin-3-yl]methanol;N,N-dimethyl-2-[(2R)-2-methyl-4-(2-methylpropyl)piperazin-1-yl]acetamide;2,2-dimethyl-1-piperazin-1-ylpropan-1-one;2-[(2R,5S)-4-(2,2-dimethylpropyl)-2,5-dimethylpiperazin-1-yl]-N,N-dimethylacetamide;1-(2,2-dimethylpropyl)piperazine.

Molecular Properties

• Compound Name: [(3S)-4-tert-butylmorpholin-3-yl]methanol;[(3R)-4-tert-butylmorpholin-3-yl]methanol;N,N-dimethyl-2-[(2R)-2-methyl-4-(2-methylpropyl)piperazin-1-yl]acetamide;2,2-dimethyl-1-piperazin-1-ylpropan-1-one;2-[(2R,5S)-4-(2,2-dimethylpropyl)-2,5-dimethylpiperazin-1-yl]-N,N-dimethylacetamide;1-(2,2-dimethylpropyl)piperazine
• PubChem CID: 161440494
• Molecular Formula: C64H134N12O7
• Molecular Weight: 1183.85 g/mol
• Exact Mass: 1183.05
• IUPAC Name: [(3S)-4-tert-butylmorpholin-3-yl]methanol;[(3R)-4-tert-butylmorpholin-3-yl]methanol;N,N-dimethyl-2-[(2R)-2-methyl-4-(2-methylpropyl)piperazin-1-yl]acetamide;2,2-dimethyl-1-piperazin-1-ylpropan-1-one;2-[(2R,5S)-4-(2,2-dimethylpropyl)-2,5-dimethylpiperazin-1-yl]-N,N-dimethylacetamide;1-(2,2-dimethylpropyl)piperazine
• SMILES: CC(C)(C)C(=O)N1CCNCC1.CC(C)(C)CN1CCNCC1.CC(C)(C)N1CCOC[C@@H]1CO.CC(C)(C)N1CCOC[C@H]1CO.CC(C)CN1CCN(CC(=O)N(C)C)[C@H](C)C1.C[C@@H]1CN(CC(C)(C)C)[C@@H](C)CN1CC(=O)N(C)C
• InChI: InChI=1S/C15H31N3O.C13H27N3O.C9H18N2O.C9H20N2.2C9H19NO2/c1-12-9-18(11-15(3,4)5)13(2)8-17(12)10-14(19)16(6)7;1-11(2)8-15-6-7-16(12(3)9-15)10-13(17)14(4)5;1-9(2,3)8(12)11-6-4-10-5-7-11;1-9(2,3)8-11-6-4-10-5-7-11;2*1-9(2,3)10-4-5-12-7-8(10)6-11/h12-13H,8-11H2,1-7H3;11-12H,6-10H2,1-5H3;10H,4-7H2,1-3H3;10H,4-8H2,1-3H3;2*8,11H,4-7H2,1-3H3/t12-,13+;12-;;;2*8-/m11..10/s1
• InChIKey: VZEZOUNPKKZLQR-AWWYTLNGSA-N
• XLogP: 4.61
• TPSA: 166.59 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 16
• Rotatable Bonds: 10
• Heavy Atoms: 83
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1183.85
LogP ≤ 5	4.61
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	16

Frequently Asked Questions

What is the IUPAC name of [(3S)-4-tert-butylmorpholin-3-yl]methanol;[(3R)-4-tert-butylmorpholin-3-yl]methanol;N,N-dimethyl-2-[(2R)-2-methyl-4-(2-methylpropyl)piperazin-1-yl]acetamide;2,2-dimethyl-1-piperazin-1-ylpropan-1-one;2-[(2R,5S)-4-(2,2-dimethylpropyl)-2,5-dimethylpiperazin-1-yl]-N,N-dimethylacetamide;1-(2,2-dimethylpropyl)piperazine?

The IUPAC name of [(3S)-4-tert-butylmorpholin-3-yl]methanol;[(3R)-4-tert-butylmorpholin-3-yl]methanol;N,N-dimethyl-2-[(2R)-2-methyl-4-(2-methylpropyl)piperazin-1-yl]acetamide;2,2-dimethyl-1-piperazin-1-ylpropan-1-one;2-[(2R,5S)-4-(2,2-dimethylpropyl)-2,5-dimethylpiperazin-1-yl]-N,N-dimethylacetamide;1-(2,2-dimethylpropyl)piperazine (CID 161440494) is [(3S)-4-tert-butylmorpholin-3-yl]methanol;[(3R)-4-tert-butylmorpholin-3-yl]methanol;N,N-dimethyl-2-[(2R)-2-methyl-4-(2-methylpropyl)piperazin-1-yl]acetamide;2,2-dimethyl-1-piperazin-1-ylpropan-1-one;2-[(2R,5S)-4-(2,2-dimethylpropyl)-2,5-dimethylpiperazin-1-yl]-N,N-dimethylacetamide;1-(2,2-dimethylpropyl)piperazine.

What is the SMILES notation for [(3S)-4-tert-butylmorpholin-3-yl]methanol;[(3R)-4-tert-butylmorpholin-3-yl]methanol;N,N-dimethyl-2-[(2R)-2-methyl-4-(2-methylpropyl)piperazin-1-yl]acetamide;2,2-dimethyl-1-piperazin-1-ylpropan-1-one;2-[(2R,5S)-4-(2,2-dimethylpropyl)-2,5-dimethylpiperazin-1-yl]-N,N-dimethylacetamide;1-(2,2-dimethylpropyl)piperazine?

The canonical SMILES for [(3S)-4-tert-butylmorpholin-3-yl]methanol;[(3R)-4-tert-butylmorpholin-3-yl]methanol;N,N-dimethyl-2-[(2R)-2-methyl-4-(2-methylpropyl)piperazin-1-yl]acetamide;2,2-dimethyl-1-piperazin-1-ylpropan-1-one;2-[(2R,5S)-4-(2,2-dimethylpropyl)-2,5-dimethylpiperazin-1-yl]-N,N-dimethylacetamide;1-(2,2-dimethylpropyl)piperazine is CC(C)(C)C(=O)N1CCNCC1.CC(C)(C)CN1CCNCC1.CC(C)(C)N1CCOC[C@@H]1CO.CC(C)(C)N1CCOC[C@H]1CO.CC(C)CN1CCN(CC(=O)N(C)C)[C@H](C)C1.C[C@@H]1CN(CC(C)(C)C)[C@@H](C)CN1CC(=O)N(C)C.

What is the InChIKey of [(3S)-4-tert-butylmorpholin-3-yl]methanol;[(3R)-4-tert-butylmorpholin-3-yl]methanol;N,N-dimethyl-2-[(2R)-2-methyl-4-(2-methylpropyl)piperazin-1-yl]acetamide;2,2-dimethyl-1-piperazin-1-ylpropan-1-one;2-[(2R,5S)-4-(2,2-dimethylpropyl)-2,5-dimethylpiperazin-1-yl]-N,N-dimethylacetamide;1-(2,2-dimethylpropyl)piperazine?

The InChIKey is VZEZOUNPKKZLQR-AWWYTLNGSA-N. The full InChI is InChI=1S/C15H31N3O.C13H27N3O.C9H18N2O.C9H20N2.2C9H19NO2/c1-12-9-18(11-15(3,4)5)13(2)8-17(12)10-14(19)16(6)7;1-11(2)8-15-6-7-16(12(3)9-15)10-13(17)14(4)5;1-9(2,3)8(12)11-6-4-10-5-7-11;1-9(2,3)8-11-6-4-10-5-7-11;2*1-9(2,3)10-4-5-12-7-8(10)6-11/h12-13H,8-11H2,1-7H3;11-12H,6-10H2,1-5H3;10H,4-7H2,1-3H3;10H,4-8H2,1-3H3;2*8,11H,4-7H2,1-3H3/t12-,13+;12-;;;2*8-/m11..10/s1.

What are the key properties of [(3S)-4-tert-butylmorpholin-3-yl]methanol;[(3R)-4-tert-butylmorpholin-3-yl]methanol;N,N-dimethyl-2-[(2R)-2-methyl-4-(2-methylpropyl)piperazin-1-yl]acetamide;2,2-dimethyl-1-piperazin-1-ylpropan-1-one;2-[(2R,5S)-4-(2,2-dimethylpropyl)-2,5-dimethylpiperazin-1-yl]-N,N-dimethylacetamide;1-(2,2-dimethylpropyl)piperazine?

[(3S)-4-tert-butylmorpholin-3-yl]methanol;[(3R)-4-tert-butylmorpholin-3-yl]methanol;N,N-dimethyl-2-[(2R)-2-methyl-4-(2-methylpropyl)piperazin-1-yl]acetamide;2,2-dimethyl-1-piperazin-1-ylpropan-1-one;2-[(2R,5S)-4-(2,2-dimethylpropyl)-2,5-dimethylpiperazin-1-yl]-N,N-dimethylacetamide;1-(2,2-dimethylpropyl)piperazine has a molecular weight of 1183.85 g/mol, XLogP of 4.61, 10 rotatable bonds, 4 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for [(3S)-4-tert-butylmorpholin-3-yl]methanol;[(3R)-4-tert-butylmorpholin-3-yl]methanol;N,N-dimethyl-2-[(2R)-2-methyl-4-(2-methylpropyl)piperazin-1-yl]acetamide;2,2-dimethyl-1-piperazin-1-ylpropan-1-one;2-[(2R,5S)-4-(2,2-dimethylpropyl)-2,5-dimethylpiperazin-1-yl]-N,N-dimethylacetamide;1-(2,2-dimethylpropyl)piperazine is sourced from PubChem (CID 161440494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).