tris(1,4-dimethylpiperazine);1,4-dimethylpiperidine;3-ethyl-1-methylpiperazine;2-ethyl-1-methylpyrrolidine;methane;3-(methoxymethyl)-1-methylpyrrolidine;2-(4-methylpiperazin-1-yl)ethanol;tris(1-methylpiperidine);1-methylpiperidin-4-ol;(1-methylpiperidin-2-yl)methanol;(1-methylpiperidin-4-yl)methanol;1-methyl-3-propan-2-ylpyrrolidine;bis(1-methylpyrrolidine);1-methylpyrrolidin-3-ol;2,4,6-trimethylmorpholine;1,2,6-trimethylpiperidine

C131H291N25O7 — CID 158717466

About tris(1,4-dimethylpiperazine);1,4-dimethylpiperidine;3-ethyl-1-methylpiperazine;2-ethyl-1-methylpyrrolidine;methane;3-(methoxymethyl)-1-methylpyrrolidine;2-(4-methylpiperazin-1-yl)ethanol;tris(1-methylpiperidine);1-methylpiperidin-4-ol;(1-methylpiperidin-2-yl)methanol;(1-methylpiperidin-4-yl)methanol;1-methyl-3-propan-2-ylpyrrolidine;bis(1-methylpyrrolidine);1-methylpyrrolidin-3-ol;2,4,6-trimethylmorpholine;1,2,6-trimethylpiperidine

tris(1,4-dimethylpiperazine);1,4-dimethylpiperidine;3-ethyl-1-methylpiperazine;2-ethyl-1-methylpyrrolidine;methane;3-(methoxymethyl)-1-methylpyrrolidine;2-(4-methylpiperazin-1-yl)ethanol;tris(1-methylpiperidine);1-methylpiperidin-4-ol;(1-methylpiperidin-2-yl)methanol;(1-methylpiperidin-4-yl)methanol;1-methyl-3-propan-2-ylpyrrolidine;bis(1-methylpyrrolidine);1-methylpyrrolidin-3-ol;2,4,6-trimethylmorpholine;1,2,6-trimethylpiperidine (PubChem CID 158717466) has the molecular formula C131H291N25O7 and a molecular weight of 2328.94 g/mol. Its IUPAC name is tris(1,4-dimethylpiperazine);1,4-dimethylpiperidine;3-ethyl-1-methylpiperazine;2-ethyl-1-methylpyrrolidine;methane;3-(methoxymethyl)-1-methylpyrrolidine;2-(4-methylpiperazin-1-yl)ethanol;tris(1-methylpiperidine);1-methylpiperidin-4-ol;(1-methylpiperidin-2-yl)methanol;(1-methylpiperidin-4-yl)methanol;1-methyl-3-propan-2-ylpyrrolidine;bis(1-methylpyrrolidine);1-methylpyrrolidin-3-ol;2,4,6-trimethylmorpholine;1,2,6-trimethylpiperidine.

Molecular Properties

• Compound Name: tris(1,4-dimethylpiperazine);1,4-dimethylpiperidine;3-ethyl-1-methylpiperazine;2-ethyl-1-methylpyrrolidine;methane;3-(methoxymethyl)-1-methylpyrrolidine;2-(4-methylpiperazin-1-yl)ethanol;tris(1-methylpiperidine);1-methylpiperidin-4-ol;(1-methylpiperidin-2-yl)methanol;(1-methylpiperidin-4-yl)methanol;1-methyl-3-propan-2-ylpyrrolidine;bis(1-methylpyrrolidine);1-methylpyrrolidin-3-ol;2,4,6-trimethylmorpholine;1,2,6-trimethylpiperidine
• PubChem CID: 158717466
• Molecular Formula: C131H291N25O7
• Molecular Weight: 2328.94 g/mol
• Exact Mass: 2327.32
• IUPAC Name: tris(1,4-dimethylpiperazine);1,4-dimethylpiperidine;3-ethyl-1-methylpiperazine;2-ethyl-1-methylpyrrolidine;methane;3-(methoxymethyl)-1-methylpyrrolidine;2-(4-methylpiperazin-1-yl)ethanol;tris(1-methylpiperidine);1-methylpiperidin-4-ol;(1-methylpiperidin-2-yl)methanol;(1-methylpiperidin-4-yl)methanol;1-methyl-3-propan-2-ylpyrrolidine;bis(1-methylpyrrolidine);1-methylpyrrolidin-3-ol;2,4,6-trimethylmorpholine;1,2,6-trimethylpiperidine
• SMILES: C.C.CC(C)C1CCN(C)C1.CC1CCCC(C)N1C.CC1CCN(C)CC1.CC1CN(C)CC(C)O1.CCC1CCCN1C.CCC1CN(C)CCN1.CN1CCC(CO)CC1.CN1CCC(O)C1.CN1CCC(O)CC1.CN1CCCC1.CN1CCCC1.CN1CCCCC1.CN1CCCCC1.CN1CCCCC1.CN1CCCCC1CO.CN1CCN(C)CC1.CN1CCN(C)CC1.CN1CCN(C)CC1.CN1CCN(CCO)CC1.COCC1CCN(C)C1
• InChI: InChI=1S/2C8H17N.C7H16N2O.C7H16N2.4C7H15NO.2C7H15N.3C6H14N2.C6H13NO.3C6H13N.C5H11NO.2C5H11N.2CH4/c1-7(2)8-4-5-9(3)6-8;1-7-5-4-6-8(2)9(7)3;1-8-2-4-9(5-3-8)6-7-10;1-3-7-6-9(2)5-4-8-7;1-6-4-8(3)5-7(2)9-6;1-8-4-3-7(5-8)6-9-2;1-8-4-2-7(6-9)3-5-8;1-8-5-3-2-4-7(8)6-9;1-7-3-5-8(2)6-4-7;1-3-7-5-4-6-8(7)2;3*1-7-3-5-8(2)6-4-7;1-7-4-2-6(8)3-5-7;3*1-7-5-3-2-4-6-7;1-6-3-2-5(7)4-6;2*1-6-4-2-3-5-6;;/h2*7-8H,4-6H2,1-3H3;10H,2-7H2,1H3;7-8H,3-6H2,1-2H3;6-7H,4-5H2,1-3H3;7H,3-6H2,1-2H3;2*7,9H,2-6H2,1H3;2*7H,3-6H2,1-2H3;3*3-6H2,1-2H3;6,8H,2-5H2,1H3;3*2-6H2,1H3;5,7H,2-4H2,1H3;2*2-5H2,1H3;2*1H4
• InChIKey: IJMOGXOOHZMLDS-UHFFFAOYSA-N
• XLogP: 13.28
• TPSA: 209.40 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 32
• Rotatable Bonds: 9
• Heavy Atoms: 163
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2328.94
LogP ≤ 5	13.28
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	32

Frequently Asked Questions

What is the IUPAC name of tris(1,4-dimethylpiperazine);1,4-dimethylpiperidine;3-ethyl-1-methylpiperazine;2-ethyl-1-methylpyrrolidine;methane;3-(methoxymethyl)-1-methylpyrrolidine;2-(4-methylpiperazin-1-yl)ethanol;tris(1-methylpiperidine);1-methylpiperidin-4-ol;(1-methylpiperidin-2-yl)methanol;(1-methylpiperidin-4-yl)methanol;1-methyl-3-propan-2-ylpyrrolidine;bis(1-methylpyrrolidine);1-methylpyrrolidin-3-ol;2,4,6-trimethylmorpholine;1,2,6-trimethylpiperidine?

The IUPAC name of tris(1,4-dimethylpiperazine);1,4-dimethylpiperidine;3-ethyl-1-methylpiperazine;2-ethyl-1-methylpyrrolidine;methane;3-(methoxymethyl)-1-methylpyrrolidine;2-(4-methylpiperazin-1-yl)ethanol;tris(1-methylpiperidine);1-methylpiperidin-4-ol;(1-methylpiperidin-2-yl)methanol;(1-methylpiperidin-4-yl)methanol;1-methyl-3-propan-2-ylpyrrolidine;bis(1-methylpyrrolidine);1-methylpyrrolidin-3-ol;2,4,6-trimethylmorpholine;1,2,6-trimethylpiperidine (CID 158717466) is tris(1,4-dimethylpiperazine);1,4-dimethylpiperidine;3-ethyl-1-methylpiperazine;2-ethyl-1-methylpyrrolidine;methane;3-(methoxymethyl)-1-methylpyrrolidine;2-(4-methylpiperazin-1-yl)ethanol;tris(1-methylpiperidine);1-methylpiperidin-4-ol;(1-methylpiperidin-2-yl)methanol;(1-methylpiperidin-4-yl)methanol;1-methyl-3-propan-2-ylpyrrolidine;bis(1-methylpyrrolidine);1-methylpyrrolidin-3-ol;2,4,6-trimethylmorpholine;1,2,6-trimethylpiperidine.

What is the SMILES notation for tris(1,4-dimethylpiperazine);1,4-dimethylpiperidine;3-ethyl-1-methylpiperazine;2-ethyl-1-methylpyrrolidine;methane;3-(methoxymethyl)-1-methylpyrrolidine;2-(4-methylpiperazin-1-yl)ethanol;tris(1-methylpiperidine);1-methylpiperidin-4-ol;(1-methylpiperidin-2-yl)methanol;(1-methylpiperidin-4-yl)methanol;1-methyl-3-propan-2-ylpyrrolidine;bis(1-methylpyrrolidine);1-methylpyrrolidin-3-ol;2,4,6-trimethylmorpholine;1,2,6-trimethylpiperidine?

The canonical SMILES for tris(1,4-dimethylpiperazine);1,4-dimethylpiperidine;3-ethyl-1-methylpiperazine;2-ethyl-1-methylpyrrolidine;methane;3-(methoxymethyl)-1-methylpyrrolidine;2-(4-methylpiperazin-1-yl)ethanol;tris(1-methylpiperidine);1-methylpiperidin-4-ol;(1-methylpiperidin-2-yl)methanol;(1-methylpiperidin-4-yl)methanol;1-methyl-3-propan-2-ylpyrrolidine;bis(1-methylpyrrolidine);1-methylpyrrolidin-3-ol;2,4,6-trimethylmorpholine;1,2,6-trimethylpiperidine is C.C.CC(C)C1CCN(C)C1.CC1CCCC(C)N1C.CC1CCN(C)CC1.CC1CN(C)CC(C)O1.CCC1CCCN1C.CCC1CN(C)CCN1.CN1CCC(CO)CC1.CN1CCC(O)C1.CN1CCC(O)CC1.CN1CCCC1.CN1CCCC1.CN1CCCCC1.CN1CCCCC1.CN1CCCCC1.CN1CCCCC1CO.CN1CCN(C)CC1.CN1CCN(C)CC1.CN1CCN(C)CC1.CN1CCN(CCO)CC1.COCC1CCN(C)C1.

What is the InChIKey of tris(1,4-dimethylpiperazine);1,4-dimethylpiperidine;3-ethyl-1-methylpiperazine;2-ethyl-1-methylpyrrolidine;methane;3-(methoxymethyl)-1-methylpyrrolidine;2-(4-methylpiperazin-1-yl)ethanol;tris(1-methylpiperidine);1-methylpiperidin-4-ol;(1-methylpiperidin-2-yl)methanol;(1-methylpiperidin-4-yl)methanol;1-methyl-3-propan-2-ylpyrrolidine;bis(1-methylpyrrolidine);1-methylpyrrolidin-3-ol;2,4,6-trimethylmorpholine;1,2,6-trimethylpiperidine?

The InChIKey is IJMOGXOOHZMLDS-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H17N.C7H16N2O.C7H16N2.4C7H15NO.2C7H15N.3C6H14N2.C6H13NO.3C6H13N.C5H11NO.2C5H11N.2CH4/c1-7(2)8-4-5-9(3)6-8;1-7-5-4-6-8(2)9(7)3;1-8-2-4-9(5-3-8)6-7-10;1-3-7-6-9(2)5-4-8-7;1-6-4-8(3)5-7(2)9-6;1-8-4-3-7(5-8)6-9-2;1-8-4-2-7(6-9)3-5-8;1-8-5-3-2-4-7(8)6-9;1-7-3-5-8(2)6-4-7;1-3-7-5-4-6-8(7)2;3*1-7-3-5-8(2)6-4-7;1-7-4-2-6(8)3-5-7;3*1-7-5-3-2-4-6-7;1-6-3-2-5(7)4-6;2*1-6-4-2-3-5-6;;/h2*7-8H,4-6H2,1-3H3;10H,2-7H2,1H3;7-8H,3-6H2,1-2H3;6-7H,4-5H2,1-3H3;7H,3-6H2,1-2H3;2*7,9H,2-6H2,1H3;2*7H,3-6H2,1-2H3;3*3-6H2,1-2H3;6,8H,2-5H2,1H3;3*2-6H2,1H3;5,7H,2-4H2,1H3;2*2-5H2,1H3;2*1H4.

What are the key properties of tris(1,4-dimethylpiperazine);1,4-dimethylpiperidine;3-ethyl-1-methylpiperazine;2-ethyl-1-methylpyrrolidine;methane;3-(methoxymethyl)-1-methylpyrrolidine;2-(4-methylpiperazin-1-yl)ethanol;tris(1-methylpiperidine);1-methylpiperidin-4-ol;(1-methylpiperidin-2-yl)methanol;(1-methylpiperidin-4-yl)methanol;1-methyl-3-propan-2-ylpyrrolidine;bis(1-methylpyrrolidine);1-methylpyrrolidin-3-ol;2,4,6-trimethylmorpholine;1,2,6-trimethylpiperidine?

tris(1,4-dimethylpiperazine);1,4-dimethylpiperidine;3-ethyl-1-methylpiperazine;2-ethyl-1-methylpyrrolidine;methane;3-(methoxymethyl)-1-methylpyrrolidine;2-(4-methylpiperazin-1-yl)ethanol;tris(1-methylpiperidine);1-methylpiperidin-4-ol;(1-methylpiperidin-2-yl)methanol;(1-methylpiperidin-4-yl)methanol;1-methyl-3-propan-2-ylpyrrolidine;bis(1-methylpyrrolidine);1-methylpyrrolidin-3-ol;2,4,6-trimethylmorpholine;1,2,6-trimethylpiperidine has a molecular weight of 2328.94 g/mol, XLogP of 13.28, 9 rotatable bonds, 6 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for tris(1,4-dimethylpiperazine);1,4-dimethylpiperidine;3-ethyl-1-methylpiperazine;2-ethyl-1-methylpyrrolidine;methane;3-(methoxymethyl)-1-methylpyrrolidine;2-(4-methylpiperazin-1-yl)ethanol;tris(1-methylpiperidine);1-methylpiperidin-4-ol;(1-methylpiperidin-2-yl)methanol;(1-methylpiperidin-4-yl)methanol;1-methyl-3-propan-2-ylpyrrolidine;bis(1-methylpyrrolidine);1-methylpyrrolidin-3-ol;2,4,6-trimethylmorpholine;1,2,6-trimethylpiperidine is sourced from PubChem (CID 158717466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).