1-(2,2-dimethylpropyl)-4-ethylpiperazine;1-(2,2-dimethylpropyl)-4-methylpiperazine;tris(1-(2,2-dimethylpropyl)-4-methylpiperidine);1-[4-(2,2-dimethylpropyl)piperazin-1-yl]ethanone;[4-(2,2-dimethylpropyl)piperazin-1-yl]-methyl-methylidene-oxo-λ6-sulfane;bis(1-(2,2-dimethylpropyl)piperidine);1-(2,2-dimethylpropyl)-4-propan-2-ylpiperazine

C108H229N15O2S — CID 165007278

About 1-(2,2-dimethylpropyl)-4-ethylpiperazine;1-(2,2-dimethylpropyl)-4-methylpiperazine;tris(1-(2,2-dimethylpropyl)-4-methylpiperidine);1-[4-(2,2-dimethylpropyl)piperazin-1-yl]ethanone;[4-(2,2-dimethylpropyl)piperazin-1-yl]-methyl-methylidene-oxo-λ6-sulfane;bis(1-(2,2-dimethylpropyl)piperidine);1-(2,2-dimethylpropyl)-4-propan-2-ylpiperazine

1-(2,2-dimethylpropyl)-4-ethylpiperazine;1-(2,2-dimethylpropyl)-4-methylpiperazine;tris(1-(2,2-dimethylpropyl)-4-methylpiperidine);1-[4-(2,2-dimethylpropyl)piperazin-1-yl]ethanone;[4-(2,2-dimethylpropyl)piperazin-1-yl]-methyl-methylidene-oxo-λ6-sulfane;bis(1-(2,2-dimethylpropyl)piperidine);1-(2,2-dimethylpropyl)-4-propan-2-ylpiperazine (PubChem CID 165007278) has the molecular formula C108H229N15O2S and a molecular weight of 1802.19 g/mol. Its IUPAC name is 1-(2,2-dimethylpropyl)-4-ethylpiperazine;1-(2,2-dimethylpropyl)-4-methylpiperazine;tris(1-(2,2-dimethylpropyl)-4-methylpiperidine);1-[4-(2,2-dimethylpropyl)piperazin-1-yl]ethanone;[4-(2,2-dimethylpropyl)piperazin-1-yl]-methyl-methylidene-oxo-λ6-sulfane;bis(1-(2,2-dimethylpropyl)piperidine);1-(2,2-dimethylpropyl)-4-propan-2-ylpiperazine.

Molecular Properties

• Compound Name: 1-(2,2-dimethylpropyl)-4-ethylpiperazine;1-(2,2-dimethylpropyl)-4-methylpiperazine;tris(1-(2,2-dimethylpropyl)-4-methylpiperidine);1-[4-(2,2-dimethylpropyl)piperazin-1-yl]ethanone;[4-(2,2-dimethylpropyl)piperazin-1-yl]-methyl-methylidene-oxo-λ6-sulfane;bis(1-(2,2-dimethylpropyl)piperidine);1-(2,2-dimethylpropyl)-4-propan-2-ylpiperazine
• PubChem CID: 165007278
• Molecular Formula: C108H229N15O2S
• Molecular Weight: 1802.19 g/mol
• Exact Mass: 1800.80
• IUPAC Name: 1-(2,2-dimethylpropyl)-4-ethylpiperazine;1-(2,2-dimethylpropyl)-4-methylpiperazine;tris(1-(2,2-dimethylpropyl)-4-methylpiperidine);1-[4-(2,2-dimethylpropyl)piperazin-1-yl]ethanone;[4-(2,2-dimethylpropyl)piperazin-1-yl]-methyl-methylidene-oxo-λ6-sulfane;bis(1-(2,2-dimethylpropyl)piperidine);1-(2,2-dimethylpropyl)-4-propan-2-ylpiperazine
• SMILES: C=S(C)(=O)N1CCN(CC(C)(C)C)CC1.CC(=O)N1CCN(CC(C)(C)C)CC1.CC(C)(C)CN1CCCCC1.CC(C)(C)CN1CCCCC1.CC(C)N1CCN(CC(C)(C)C)CC1.CC1CCN(CC(C)(C)C)CC1.CC1CCN(CC(C)(C)C)CC1.CC1CCN(CC(C)(C)C)CC1.CCN1CCN(CC(C)(C)C)CC1.CN1CCN(CC(C)(C)C)CC1
• InChI: InChI=1S/C12H26N2.C11H24N2OS.C11H22N2O.C11H24N2.3C11H23N.C10H22N2.2C10H21N/c1-11(2)14-8-6-13(7-9-14)10-12(3,4)5;1-11(2,3)10-12-6-8-13(9-7-12)15(4,5)14;1-10(14)13-7-5-12(6-8-13)9-11(2,3)4;1-5-12-6-8-13(9-7-12)10-11(2,3)4;3*1-10-5-7-12(8-6-10)9-11(2,3)4;1-10(2,3)9-12-7-5-11(4)6-8-12;2*1-10(2,3)9-11-7-5-4-6-8-11/h11H,6-10H2,1-5H3;4,6-10H2,1-3,5H3;5-9H2,1-4H3;5-10H2,1-4H3;3*10H,5-9H2,1-4H3;5-9H2,1-4H3;2*4-9H2,1-3H3
• InChIKey: JDNVULYMLQTYMG-UHFFFAOYSA-N
• XLogP: 20.45
• TPSA: 82.74 Ų
• H-Bond Acceptors: 15
• Rotatable Bonds: 13
• Heavy Atoms: 126
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1802.19
LogP ≤ 5	20.45
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	15

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethylpropyl)-4-ethylpiperazine;1-(2,2-dimethylpropyl)-4-methylpiperazine;tris(1-(2,2-dimethylpropyl)-4-methylpiperidine);1-[4-(2,2-dimethylpropyl)piperazin-1-yl]ethanone;[4-(2,2-dimethylpropyl)piperazin-1-yl]-methyl-methylidene-oxo-λ6-sulfane;bis(1-(2,2-dimethylpropyl)piperidine);1-(2,2-dimethylpropyl)-4-propan-2-ylpiperazine?

The IUPAC name of 1-(2,2-dimethylpropyl)-4-ethylpiperazine;1-(2,2-dimethylpropyl)-4-methylpiperazine;tris(1-(2,2-dimethylpropyl)-4-methylpiperidine);1-[4-(2,2-dimethylpropyl)piperazin-1-yl]ethanone;[4-(2,2-dimethylpropyl)piperazin-1-yl]-methyl-methylidene-oxo-λ6-sulfane;bis(1-(2,2-dimethylpropyl)piperidine);1-(2,2-dimethylpropyl)-4-propan-2-ylpiperazine (CID 165007278) is 1-(2,2-dimethylpropyl)-4-ethylpiperazine;1-(2,2-dimethylpropyl)-4-methylpiperazine;tris(1-(2,2-dimethylpropyl)-4-methylpiperidine);1-[4-(2,2-dimethylpropyl)piperazin-1-yl]ethanone;[4-(2,2-dimethylpropyl)piperazin-1-yl]-methyl-methylidene-oxo-λ6-sulfane;bis(1-(2,2-dimethylpropyl)piperidine);1-(2,2-dimethylpropyl)-4-propan-2-ylpiperazine.

What is the SMILES notation for 1-(2,2-dimethylpropyl)-4-ethylpiperazine;1-(2,2-dimethylpropyl)-4-methylpiperazine;tris(1-(2,2-dimethylpropyl)-4-methylpiperidine);1-[4-(2,2-dimethylpropyl)piperazin-1-yl]ethanone;[4-(2,2-dimethylpropyl)piperazin-1-yl]-methyl-methylidene-oxo-λ6-sulfane;bis(1-(2,2-dimethylpropyl)piperidine);1-(2,2-dimethylpropyl)-4-propan-2-ylpiperazine?

The canonical SMILES for 1-(2,2-dimethylpropyl)-4-ethylpiperazine;1-(2,2-dimethylpropyl)-4-methylpiperazine;tris(1-(2,2-dimethylpropyl)-4-methylpiperidine);1-[4-(2,2-dimethylpropyl)piperazin-1-yl]ethanone;[4-(2,2-dimethylpropyl)piperazin-1-yl]-methyl-methylidene-oxo-λ6-sulfane;bis(1-(2,2-dimethylpropyl)piperidine);1-(2,2-dimethylpropyl)-4-propan-2-ylpiperazine is C=S(C)(=O)N1CCN(CC(C)(C)C)CC1.CC(=O)N1CCN(CC(C)(C)C)CC1.CC(C)(C)CN1CCCCC1.CC(C)(C)CN1CCCCC1.CC(C)N1CCN(CC(C)(C)C)CC1.CC1CCN(CC(C)(C)C)CC1.CC1CCN(CC(C)(C)C)CC1.CC1CCN(CC(C)(C)C)CC1.CCN1CCN(CC(C)(C)C)CC1.CN1CCN(CC(C)(C)C)CC1.

What is the InChIKey of 1-(2,2-dimethylpropyl)-4-ethylpiperazine;1-(2,2-dimethylpropyl)-4-methylpiperazine;tris(1-(2,2-dimethylpropyl)-4-methylpiperidine);1-[4-(2,2-dimethylpropyl)piperazin-1-yl]ethanone;[4-(2,2-dimethylpropyl)piperazin-1-yl]-methyl-methylidene-oxo-λ6-sulfane;bis(1-(2,2-dimethylpropyl)piperidine);1-(2,2-dimethylpropyl)-4-propan-2-ylpiperazine?

The InChIKey is JDNVULYMLQTYMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2.C11H24N2OS.C11H22N2O.C11H24N2.3C11H23N.C10H22N2.2C10H21N/c1-11(2)14-8-6-13(7-9-14)10-12(3,4)5;1-11(2,3)10-12-6-8-13(9-7-12)15(4,5)14;1-10(14)13-7-5-12(6-8-13)9-11(2,3)4;1-5-12-6-8-13(9-7-12)10-11(2,3)4;3*1-10-5-7-12(8-6-10)9-11(2,3)4;1-10(2,3)9-12-7-5-11(4)6-8-12;2*1-10(2,3)9-11-7-5-4-6-8-11/h11H,6-10H2,1-5H3;4,6-10H2,1-3,5H3;5-9H2,1-4H3;5-10H2,1-4H3;3*10H,5-9H2,1-4H3;5-9H2,1-4H3;2*4-9H2,1-3H3.

What are the key properties of 1-(2,2-dimethylpropyl)-4-ethylpiperazine;1-(2,2-dimethylpropyl)-4-methylpiperazine;tris(1-(2,2-dimethylpropyl)-4-methylpiperidine);1-[4-(2,2-dimethylpropyl)piperazin-1-yl]ethanone;[4-(2,2-dimethylpropyl)piperazin-1-yl]-methyl-methylidene-oxo-λ6-sulfane;bis(1-(2,2-dimethylpropyl)piperidine);1-(2,2-dimethylpropyl)-4-propan-2-ylpiperazine?

1-(2,2-dimethylpropyl)-4-ethylpiperazine;1-(2,2-dimethylpropyl)-4-methylpiperazine;tris(1-(2,2-dimethylpropyl)-4-methylpiperidine);1-[4-(2,2-dimethylpropyl)piperazin-1-yl]ethanone;[4-(2,2-dimethylpropyl)piperazin-1-yl]-methyl-methylidene-oxo-λ6-sulfane;bis(1-(2,2-dimethylpropyl)piperidine);1-(2,2-dimethylpropyl)-4-propan-2-ylpiperazine has a molecular weight of 1802.19 g/mol, XLogP of 20.45, 13 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(2,2-dimethylpropyl)-4-ethylpiperazine;1-(2,2-dimethylpropyl)-4-methylpiperazine;tris(1-(2,2-dimethylpropyl)-4-methylpiperidine);1-[4-(2,2-dimethylpropyl)piperazin-1-yl]ethanone;[4-(2,2-dimethylpropyl)piperazin-1-yl]-methyl-methylidene-oxo-λ6-sulfane;bis(1-(2,2-dimethylpropyl)piperidine);1-(2,2-dimethylpropyl)-4-propan-2-ylpiperazine is sourced from PubChem (CID 165007278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).