1-(4-ethylpiperazin-1-yl)butan-1-one;1-(4-ethylpiperazin-1-yl)propan-1-one;1-(1-ethylpiperidin-4-yl)pentan-1-one;1-ethyl-4-(2-propoxyethyl)piperidine;1-ethyl-3-propoxypiperidine;1-ethyl-4-propoxypiperidine;1-ethyl-4-propylpiperazine;propyl 2-(1-propylpiperidin-4-yl)acetate

C85H173N11O8 — CID 159738656

About 1-(4-ethylpiperazin-1-yl)butan-1-one;1-(4-ethylpiperazin-1-yl)propan-1-one;1-(1-ethylpiperidin-4-yl)pentan-1-one;1-ethyl-4-(2-propoxyethyl)piperidine;1-ethyl-3-propoxypiperidine;1-ethyl-4-propoxypiperidine;1-ethyl-4-propylpiperazine;propyl 2-(1-propylpiperidin-4-yl)acetate

1-(4-ethylpiperazin-1-yl)butan-1-one;1-(4-ethylpiperazin-1-yl)propan-1-one;1-(1-ethylpiperidin-4-yl)pentan-1-one;1-ethyl-4-(2-propoxyethyl)piperidine;1-ethyl-3-propoxypiperidine;1-ethyl-4-propoxypiperidine;1-ethyl-4-propylpiperazine;propyl 2-(1-propylpiperidin-4-yl)acetate (PubChem CID 159738656) has the molecular formula C85H173N11O8 and a molecular weight of 1477.39 g/mol. Its IUPAC name is 1-(4-ethylpiperazin-1-yl)butan-1-one;1-(4-ethylpiperazin-1-yl)propan-1-one;1-(1-ethylpiperidin-4-yl)pentan-1-one;1-ethyl-4-(2-propoxyethyl)piperidine;1-ethyl-3-propoxypiperidine;1-ethyl-4-propoxypiperidine;1-ethyl-4-propylpiperazine;propyl 2-(1-propylpiperidin-4-yl)acetate.

Molecular Properties

• Compound Name: 1-(4-ethylpiperazin-1-yl)butan-1-one;1-(4-ethylpiperazin-1-yl)propan-1-one;1-(1-ethylpiperidin-4-yl)pentan-1-one;1-ethyl-4-(2-propoxyethyl)piperidine;1-ethyl-3-propoxypiperidine;1-ethyl-4-propoxypiperidine;1-ethyl-4-propylpiperazine;propyl 2-(1-propylpiperidin-4-yl)acetate
• PubChem CID: 159738656
• Molecular Formula: C85H173N11O8
• Molecular Weight: 1477.39 g/mol
• Exact Mass: 1476.35
• IUPAC Name: 1-(4-ethylpiperazin-1-yl)butan-1-one;1-(4-ethylpiperazin-1-yl)propan-1-one;1-(1-ethylpiperidin-4-yl)pentan-1-one;1-ethyl-4-(2-propoxyethyl)piperidine;1-ethyl-3-propoxypiperidine;1-ethyl-4-propoxypiperidine;1-ethyl-4-propylpiperazine;propyl 2-(1-propylpiperidin-4-yl)acetate
• SMILES: CCC(=O)N1CCN(CC)CC1.CCCC(=O)N1CCN(CC)CC1.CCCCC(=O)C1CCN(CC)CC1.CCCN1CCN(CC)CC1.CCCOC(=O)CC1CCN(CCC)CC1.CCCOC1CCCN(CC)C1.CCCOC1CCN(CC)CC1.CCCOCCC1CCN(CC)CC1
• InChI: InChI=1S/C13H25NO2.C12H25NO.C12H23NO.C10H20N2O.2C10H21NO.C9H18N2O.C9H20N2/c1-3-7-14-8-5-12(6-9-14)11-13(15)16-10-4-2;1-3-10-14-11-7-12-5-8-13(4-2)9-6-12;1-3-5-6-12(14)11-7-9-13(4-2)10-8-11;1-3-5-10(13)12-8-6-11(4-2)7-9-12;1-3-9-12-10-5-7-11(4-2)8-6-10;1-3-8-12-10-6-5-7-11(4-2)9-10;1-3-9(12)11-7-5-10(4-2)6-8-11;1-3-5-11-8-6-10(4-2)7-9-11/h12H,3-11H2,1-2H3;12H,3-11H2,1-2H3;11H,3-10H2,1-2H3;3-9H2,1-2H3;2*10H,3-9H2,1-2H3;3-8H2,1-2H3;3-9H2,1-2H3
• InChIKey: NCDVEZOMRRXTMW-UHFFFAOYSA-N
• XLogP: 13.80
• TPSA: 140.84 Ų
• H-Bond Acceptors: 17
• Rotatable Bonds: 33
• Heavy Atoms: 104
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1477.39
LogP ≤ 5	13.80
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylpiperazin-1-yl)butan-1-one;1-(4-ethylpiperazin-1-yl)propan-1-one;1-(1-ethylpiperidin-4-yl)pentan-1-one;1-ethyl-4-(2-propoxyethyl)piperidine;1-ethyl-3-propoxypiperidine;1-ethyl-4-propoxypiperidine;1-ethyl-4-propylpiperazine;propyl 2-(1-propylpiperidin-4-yl)acetate?

The IUPAC name of 1-(4-ethylpiperazin-1-yl)butan-1-one;1-(4-ethylpiperazin-1-yl)propan-1-one;1-(1-ethylpiperidin-4-yl)pentan-1-one;1-ethyl-4-(2-propoxyethyl)piperidine;1-ethyl-3-propoxypiperidine;1-ethyl-4-propoxypiperidine;1-ethyl-4-propylpiperazine;propyl 2-(1-propylpiperidin-4-yl)acetate (CID 159738656) is 1-(4-ethylpiperazin-1-yl)butan-1-one;1-(4-ethylpiperazin-1-yl)propan-1-one;1-(1-ethylpiperidin-4-yl)pentan-1-one;1-ethyl-4-(2-propoxyethyl)piperidine;1-ethyl-3-propoxypiperidine;1-ethyl-4-propoxypiperidine;1-ethyl-4-propylpiperazine;propyl 2-(1-propylpiperidin-4-yl)acetate.

What is the SMILES notation for 1-(4-ethylpiperazin-1-yl)butan-1-one;1-(4-ethylpiperazin-1-yl)propan-1-one;1-(1-ethylpiperidin-4-yl)pentan-1-one;1-ethyl-4-(2-propoxyethyl)piperidine;1-ethyl-3-propoxypiperidine;1-ethyl-4-propoxypiperidine;1-ethyl-4-propylpiperazine;propyl 2-(1-propylpiperidin-4-yl)acetate?

The canonical SMILES for 1-(4-ethylpiperazin-1-yl)butan-1-one;1-(4-ethylpiperazin-1-yl)propan-1-one;1-(1-ethylpiperidin-4-yl)pentan-1-one;1-ethyl-4-(2-propoxyethyl)piperidine;1-ethyl-3-propoxypiperidine;1-ethyl-4-propoxypiperidine;1-ethyl-4-propylpiperazine;propyl 2-(1-propylpiperidin-4-yl)acetate is CCC(=O)N1CCN(CC)CC1.CCCC(=O)N1CCN(CC)CC1.CCCCC(=O)C1CCN(CC)CC1.CCCN1CCN(CC)CC1.CCCOC(=O)CC1CCN(CCC)CC1.CCCOC1CCCN(CC)C1.CCCOC1CCN(CC)CC1.CCCOCCC1CCN(CC)CC1.

What is the InChIKey of 1-(4-ethylpiperazin-1-yl)butan-1-one;1-(4-ethylpiperazin-1-yl)propan-1-one;1-(1-ethylpiperidin-4-yl)pentan-1-one;1-ethyl-4-(2-propoxyethyl)piperidine;1-ethyl-3-propoxypiperidine;1-ethyl-4-propoxypiperidine;1-ethyl-4-propylpiperazine;propyl 2-(1-propylpiperidin-4-yl)acetate?

The InChIKey is NCDVEZOMRRXTMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO2.C12H25NO.C12H23NO.C10H20N2O.2C10H21NO.C9H18N2O.C9H20N2/c1-3-7-14-8-5-12(6-9-14)11-13(15)16-10-4-2;1-3-10-14-11-7-12-5-8-13(4-2)9-6-12;1-3-5-6-12(14)11-7-9-13(4-2)10-8-11;1-3-5-10(13)12-8-6-11(4-2)7-9-12;1-3-9-12-10-5-7-11(4-2)8-6-10;1-3-8-12-10-6-5-7-11(4-2)9-10;1-3-9(12)11-7-5-10(4-2)6-8-11;1-3-5-11-8-6-10(4-2)7-9-11/h12H,3-11H2,1-2H3;12H,3-11H2,1-2H3;11H,3-10H2,1-2H3;3-9H2,1-2H3;2*10H,3-9H2,1-2H3;3-8H2,1-2H3;3-9H2,1-2H3.

What are the key properties of 1-(4-ethylpiperazin-1-yl)butan-1-one;1-(4-ethylpiperazin-1-yl)propan-1-one;1-(1-ethylpiperidin-4-yl)pentan-1-one;1-ethyl-4-(2-propoxyethyl)piperidine;1-ethyl-3-propoxypiperidine;1-ethyl-4-propoxypiperidine;1-ethyl-4-propylpiperazine;propyl 2-(1-propylpiperidin-4-yl)acetate?

1-(4-ethylpiperazin-1-yl)butan-1-one;1-(4-ethylpiperazin-1-yl)propan-1-one;1-(1-ethylpiperidin-4-yl)pentan-1-one;1-ethyl-4-(2-propoxyethyl)piperidine;1-ethyl-3-propoxypiperidine;1-ethyl-4-propoxypiperidine;1-ethyl-4-propylpiperazine;propyl 2-(1-propylpiperidin-4-yl)acetate has a molecular weight of 1477.39 g/mol, XLogP of 13.80, 33 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(4-ethylpiperazin-1-yl)butan-1-one;1-(4-ethylpiperazin-1-yl)propan-1-one;1-(1-ethylpiperidin-4-yl)pentan-1-one;1-ethyl-4-(2-propoxyethyl)piperidine;1-ethyl-3-propoxypiperidine;1-ethyl-4-propoxypiperidine;1-ethyl-4-propylpiperazine;propyl 2-(1-propylpiperidin-4-yl)acetate is sourced from PubChem (CID 159738656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).