1,4-dimethylpiperidine;2-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine;2-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine;1-methyl-1,4-diazepane;1-methyl-4-methylsulfonylpiperazine;4-methylmorpholine;1-methylpiperazine;2-(4-methylpiperazin-1-yl)ethanol;4-methylpiperidine

C59H129N15O4S — CID 159968202

About 1,4-dimethylpiperidine;2-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine;2-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine;1-methyl-1,4-diazepane;1-methyl-4-methylsulfonylpiperazine;4-methylmorpholine;1-methylpiperazine;2-(4-methylpiperazin-1-yl)ethanol;4-methylpiperidine

1,4-dimethylpiperidine;2-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine;2-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine;1-methyl-1,4-diazepane;1-methyl-4-methylsulfonylpiperazine;4-methylmorpholine;1-methylpiperazine;2-(4-methylpiperazin-1-yl)ethanol;4-methylpiperidine (PubChem CID 159968202) has the molecular formula C59H129N15O4S and a molecular weight of 1144.85 g/mol. Its IUPAC name is 1,4-dimethylpiperidine;2-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine;2-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine;1-methyl-1,4-diazepane;1-methyl-4-methylsulfonylpiperazine;4-methylmorpholine;1-methylpiperazine;2-(4-methylpiperazin-1-yl)ethanol;4-methylpiperidine.

Molecular Properties

• Compound Name: 1,4-dimethylpiperidine;2-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine;2-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine;1-methyl-1,4-diazepane;1-methyl-4-methylsulfonylpiperazine;4-methylmorpholine;1-methylpiperazine;2-(4-methylpiperazin-1-yl)ethanol;4-methylpiperidine
• PubChem CID: 159968202
• Molecular Formula: C59H129N15O4S
• Molecular Weight: 1144.85 g/mol
• Exact Mass: 1144.01
• IUPAC Name: 1,4-dimethylpiperidine;2-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine;2-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine;1-methyl-1,4-diazepane;1-methyl-4-methylsulfonylpiperazine;4-methylmorpholine;1-methylpiperazine;2-(4-methylpiperazin-1-yl)ethanol;4-methylpiperidine
• SMILES: CC1CCN(C)CC1.CC1CCNCC1.CN1CCCNCC1.CN1CCN(CCO)CC1.CN1CCN(S(C)(=O)=O)CC1.CN1CCN2CCCC2C1.CN1CCN2CCCCC2C1.CN1CCNCC1.CN1CCOCC1
• InChI: InChI=1S/C9H18N2.C8H16N2.C7H16N2O.C7H15N.C6H14N2O2S.C6H14N2.C6H13N.C5H12N2.C5H11NO/c1-10-6-7-11-5-3-2-4-9(11)8-10;1-9-5-6-10-4-2-3-8(10)7-9;1-8-2-4-9(5-3-8)6-7-10;1-7-3-5-8(2)6-4-7;1-7-3-5-8(6-4-7)11(2,9)10;1-8-5-2-3-7-4-6-8;1-6-2-4-7-5-3-6;1-7-4-2-6-3-5-7;1-6-2-4-7-5-3-6/h9H,2-8H2,1H3;8H,2-7H2,1H3;10H,2-7H2,1H3;7H,3-6H2,1-2H3;3-6H2,1-2H3;7H,2-6H2,1H3;6-7H,2-5H2,1H3;6H,2-5H2,1H3;2-5H2,1H3
• InChIKey: OEFBRLYOCLGMCE-UHFFFAOYSA-N
• XLogP: 1.34
• TPSA: 138.57 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 18
• Rotatable Bonds: 3
• Heavy Atoms: 79
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1144.85
LogP ≤ 5	1.34
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	18

Frequently Asked Questions

What is the IUPAC name of 1,4-dimethylpiperidine;2-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine;2-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine;1-methyl-1,4-diazepane;1-methyl-4-methylsulfonylpiperazine;4-methylmorpholine;1-methylpiperazine;2-(4-methylpiperazin-1-yl)ethanol;4-methylpiperidine?

The IUPAC name of 1,4-dimethylpiperidine;2-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine;2-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine;1-methyl-1,4-diazepane;1-methyl-4-methylsulfonylpiperazine;4-methylmorpholine;1-methylpiperazine;2-(4-methylpiperazin-1-yl)ethanol;4-methylpiperidine (CID 159968202) is 1,4-dimethylpiperidine;2-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine;2-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine;1-methyl-1,4-diazepane;1-methyl-4-methylsulfonylpiperazine;4-methylmorpholine;1-methylpiperazine;2-(4-methylpiperazin-1-yl)ethanol;4-methylpiperidine.

What is the SMILES notation for 1,4-dimethylpiperidine;2-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine;2-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine;1-methyl-1,4-diazepane;1-methyl-4-methylsulfonylpiperazine;4-methylmorpholine;1-methylpiperazine;2-(4-methylpiperazin-1-yl)ethanol;4-methylpiperidine?

The canonical SMILES for 1,4-dimethylpiperidine;2-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine;2-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine;1-methyl-1,4-diazepane;1-methyl-4-methylsulfonylpiperazine;4-methylmorpholine;1-methylpiperazine;2-(4-methylpiperazin-1-yl)ethanol;4-methylpiperidine is CC1CCN(C)CC1.CC1CCNCC1.CN1CCCNCC1.CN1CCN(CCO)CC1.CN1CCN(S(C)(=O)=O)CC1.CN1CCN2CCCC2C1.CN1CCN2CCCCC2C1.CN1CCNCC1.CN1CCOCC1.

What is the InChIKey of 1,4-dimethylpiperidine;2-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine;2-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine;1-methyl-1,4-diazepane;1-methyl-4-methylsulfonylpiperazine;4-methylmorpholine;1-methylpiperazine;2-(4-methylpiperazin-1-yl)ethanol;4-methylpiperidine?

The InChIKey is OEFBRLYOCLGMCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2.C8H16N2.C7H16N2O.C7H15N.C6H14N2O2S.C6H14N2.C6H13N.C5H12N2.C5H11NO/c1-10-6-7-11-5-3-2-4-9(11)8-10;1-9-5-6-10-4-2-3-8(10)7-9;1-8-2-4-9(5-3-8)6-7-10;1-7-3-5-8(2)6-4-7;1-7-3-5-8(6-4-7)11(2,9)10;1-8-5-2-3-7-4-6-8;1-6-2-4-7-5-3-6;1-7-4-2-6-3-5-7;1-6-2-4-7-5-3-6/h9H,2-8H2,1H3;8H,2-7H2,1H3;10H,2-7H2,1H3;7H,3-6H2,1-2H3;3-6H2,1-2H3;7H,2-6H2,1H3;6-7H,2-5H2,1H3;6H,2-5H2,1H3;2-5H2,1H3.

What are the key properties of 1,4-dimethylpiperidine;2-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine;2-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine;1-methyl-1,4-diazepane;1-methyl-4-methylsulfonylpiperazine;4-methylmorpholine;1-methylpiperazine;2-(4-methylpiperazin-1-yl)ethanol;4-methylpiperidine?

1,4-dimethylpiperidine;2-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine;2-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine;1-methyl-1,4-diazepane;1-methyl-4-methylsulfonylpiperazine;4-methylmorpholine;1-methylpiperazine;2-(4-methylpiperazin-1-yl)ethanol;4-methylpiperidine has a molecular weight of 1144.85 g/mol, XLogP of 1.34, 3 rotatable bonds, 4 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for 1,4-dimethylpiperidine;2-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine;2-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine;1-methyl-1,4-diazepane;1-methyl-4-methylsulfonylpiperazine;4-methylmorpholine;1-methylpiperazine;2-(4-methylpiperazin-1-yl)ethanol;4-methylpiperidine is sourced from PubChem (CID 159968202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).