2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2S)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-4-propan-2-ylmorpholine;(2S)-2-ethyl-4-propan-2-ylmorpholine;2-ethyl-4-propan-2-ylmorpholine;3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;methane;[(2R)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;[(2S)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;(2S)-1-propan-2-ylpyrrolidine-2-carboxamide;(2R)-1-propan-2-ylpyrrolidine-2-carboxamide

C119H259N23O7 — CID 158761214

IUPAC2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2S)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-4-propan-2-ylmorpholine;(2S)-2-ethyl-4-propan-2-ylmorpholine;2-ethyl-4-propan-2-ylmorpholine;3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;methane;[(2R)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;[(2S)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;(2S)-1-propan-2-ylpyrrolidine-2-carboxamide;(2R)-1-propan-2-ylpyrrolidine-2-carboxamide
SMILESC.CC(C)N1CCC[C@@H]1C(N)=O.CC(C)N1CCC[C@H]1C(N)=O.CC(C)N1CCN(C)C[C@@H]1CO.CC(C)N1CCN(C)C[C@H]1CO.CCC1CN(C(C)C)CCN1.CCC1CN(C(C)C)CCN1C.CCC1CN(C(C)C)CCO1.CC[C@@H]1CN(C(C)C)CCN1.CC[C@@H]1CN(C(C)C)CCN1C.CC[C@@H]1CN(C(C)C)CCO1.CC[C@H]1CN(C(C)C)CCN1.CC[C@H]1CN(C(C)C)CCN1C.CC[C@H]1CN(C(C)C)CCO1
InChIInChI=1S/3C10H22N2.2C9H20N2O.3C9H20N2.3C9H19NO.2C8H16N2O.CH4/c3*1-5-10-8-12(9(2)3)7-6-11(10)4;2*1-8(2)11-5-4-10(3)6-9(11)7-12;3*1-4-9-7-11(8(2)3)6-5-10-9;3*1-4-9-7-10(8(2)3)5-6-11-9;2*1-6(2)10-5-3-4-7(10)8(9)11;/h3*9-10H,5-8H2,1-4H3;2*8-9,12H,4-7H2,1-3H3;3*8-10H,4-7H2,1-3H3;3*8-9H,4-7H2,1-3H3;2*6-7H,3-5H2,1-2H3,(H2,9,11);1H4/t2*10-;;4*9-;;2*9-;;2*7-;/m10.1010.10.10./s1
InChIKeyIORRAXIPYHGMDQ-DLJLSESVSA-N
MW2124.53 g/mol
LogP13.35
Rot. Bonds26

About 2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2S)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-4-propan-2-ylmorpholine;(2S)-2-ethyl-4-propan-2-ylmorpholine;2-ethyl-4-propan-2-ylmorpholine;3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;methane;[(2R)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;[(2S)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;(2S)-1-propan-2-ylpyrrolidine-2-carboxamide;(2R)-1-propan-2-ylpyrrolidine-2-carboxamide

2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2S)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-4-propan-2-ylmorpholine;(2S)-2-ethyl-4-propan-2-ylmorpholine;2-ethyl-4-propan-2-ylmorpholine;3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;methane;[(2R)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;[(2S)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;(2S)-1-propan-2-ylpyrrolidine-2-carboxamide;(2R)-1-propan-2-ylpyrrolidine-2-carboxamide (PubChem CID 158761214) has the molecular formula C119H259N23O7 and a molecular weight of 2124.53 g/mol. Its IUPAC name is 2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2S)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-4-propan-2-ylmorpholine;(2S)-2-ethyl-4-propan-2-ylmorpholine;2-ethyl-4-propan-2-ylmorpholine;3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;methane;[(2R)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;[(2S)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;(2S)-1-propan-2-ylpyrrolidine-2-carboxamide;(2R)-1-propan-2-ylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2S)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-4-propan-2-ylmorpholine;(2S)-2-ethyl-4-propan-2-ylmorpholine;2-ethyl-4-propan-2-ylmorpholine;3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;methane;[(2R)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;[(2S)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;(2S)-1-propan-2-ylpyrrolidine-2-carboxamide;(2R)-1-propan-2-ylpyrrolidine-2-carboxamide
PubChem CID158761214
Molecular FormulaC119H259N23O7
Molecular Weight2124.53 g/mol
Exact Mass2123.06
IUPAC Name2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2S)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-4-propan-2-ylmorpholine;(2S)-2-ethyl-4-propan-2-ylmorpholine;2-ethyl-4-propan-2-ylmorpholine;3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;methane;[(2R)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;[(2S)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;(2S)-1-propan-2-ylpyrrolidine-2-carboxamide;(2R)-1-propan-2-ylpyrrolidine-2-carboxamide
SMILESC.CC(C)N1CCC[C@@H]1C(N)=O.CC(C)N1CCC[C@H]1C(N)=O.CC(C)N1CCN(C)C[C@@H]1CO.CC(C)N1CCN(C)C[C@H]1CO.CCC1CN(C(C)C)CCN1.CCC1CN(C(C)C)CCN1C.CCC1CN(C(C)C)CCO1.CC[C@@H]1CN(C(C)C)CCN1.CC[C@@H]1CN(C(C)C)CCN1C.CC[C@@H]1CN(C(C)C)CCO1.CC[C@H]1CN(C(C)C)CCN1.CC[C@H]1CN(C(C)C)CCN1C.CC[C@H]1CN(C(C)C)CCO1
InChIInChI=1S/3C10H22N2.2C9H20N2O.3C9H20N2.3C9H19NO.2C8H16N2O.CH4/c3*1-5-10-8-12(9(2)3)7-6-11(10)4;2*1-8(2)11-5-4-10(3)6-9(11)7-12;3*1-4-9-7-11(8(2)3)6-5-10-9;3*1-4-9-7-10(8(2)3)5-6-11-9;2*1-6(2)10-5-3-4-7(10)8(9)11;/h3*9-10H,5-8H2,1-4H3;2*8-9,12H,4-7H2,1-3H3;3*8-10H,4-7H2,1-3H3;3*8-9H,4-7H2,1-3H3;2*6-7H,3-5H2,1-2H3,(H2,9,11);1H4/t2*10-;;4*9-;;2*9-;;2*7-;/m10.1010.10.10./s1
InChIKeyIORRAXIPYHGMDQ-DLJLSESVSA-N
XLogP13.35
TPSA248.74 Ų
H-Bond Donors7
H-Bond Acceptors28
Rotatable Bonds26
Heavy Atoms149
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002124.53
LogP ≤ 513.35
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1028

Analyze 2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2S)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-4-propan-2-ylmorpholine;(2S)-2-ethyl-4-propan-2-ylmorpholine;2-ethyl-4-propan-2-ylmorpholine;3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;methane;[(2R)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;[(2S)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;(2S)-1-propan-2-ylpyrrolidine-2-carboxamide;(2R)-1-propan-2-ylpyrrolidine-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2S)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-4-propan-2-ylmorpholine;(2S)-2-ethyl-4-propan-2-ylmorpholine;2-ethyl-4-propan-2-ylmorpholine;3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;methane;[(2R)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;[(2S)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;(2S)-1-propan-2-ylpyrrolidine-2-carboxamide;(2R)-1-propan-2-ylpyrrolidine-2-carboxamide?
The IUPAC name of 2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2S)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-4-propan-2-ylmorpholine;(2S)-2-ethyl-4-propan-2-ylmorpholine;2-ethyl-4-propan-2-ylmorpholine;3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;methane;[(2R)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;[(2S)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;(2S)-1-propan-2-ylpyrrolidine-2-carboxamide;(2R)-1-propan-2-ylpyrrolidine-2-carboxamide (CID 158761214) is 2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2S)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-4-propan-2-ylmorpholine;(2S)-2-ethyl-4-propan-2-ylmorpholine;2-ethyl-4-propan-2-ylmorpholine;3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;methane;[(2R)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;[(2S)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;(2S)-1-propan-2-ylpyrrolidine-2-carboxamide;(2R)-1-propan-2-ylpyrrolidine-2-carboxamide.
What is the SMILES notation for 2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2S)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-4-propan-2-ylmorpholine;(2S)-2-ethyl-4-propan-2-ylmorpholine;2-ethyl-4-propan-2-ylmorpholine;3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;methane;[(2R)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;[(2S)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;(2S)-1-propan-2-ylpyrrolidine-2-carboxamide;(2R)-1-propan-2-ylpyrrolidine-2-carboxamide?
The canonical SMILES for 2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2S)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-4-propan-2-ylmorpholine;(2S)-2-ethyl-4-propan-2-ylmorpholine;2-ethyl-4-propan-2-ylmorpholine;3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;methane;[(2R)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;[(2S)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;(2S)-1-propan-2-ylpyrrolidine-2-carboxamide;(2R)-1-propan-2-ylpyrrolidine-2-carboxamide is C.CC(C)N1CCC[C@@H]1C(N)=O.CC(C)N1CCC[C@H]1C(N)=O.CC(C)N1CCN(C)C[C@@H]1CO.CC(C)N1CCN(C)C[C@H]1CO.CCC1CN(C(C)C)CCN1.CCC1CN(C(C)C)CCN1C.CCC1CN(C(C)C)CCO1.CC[C@@H]1CN(C(C)C)CCN1.CC[C@@H]1CN(C(C)C)CCN1C.CC[C@@H]1CN(C(C)C)CCO1.CC[C@H]1CN(C(C)C)CCN1.CC[C@H]1CN(C(C)C)CCN1C.CC[C@H]1CN(C(C)C)CCO1.
What is the InChIKey of 2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2S)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-4-propan-2-ylmorpholine;(2S)-2-ethyl-4-propan-2-ylmorpholine;2-ethyl-4-propan-2-ylmorpholine;3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;methane;[(2R)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;[(2S)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;(2S)-1-propan-2-ylpyrrolidine-2-carboxamide;(2R)-1-propan-2-ylpyrrolidine-2-carboxamide?
The InChIKey is IORRAXIPYHGMDQ-DLJLSESVSA-N. The full InChI is InChI=1S/3C10H22N2.2C9H20N2O.3C9H20N2.3C9H19NO.2C8H16N2O.CH4/c3*1-5-10-8-12(9(2)3)7-6-11(10)4;2*1-8(2)11-5-4-10(3)6-9(11)7-12;3*1-4-9-7-11(8(2)3)6-5-10-9;3*1-4-9-7-10(8(2)3)5-6-11-9;2*1-6(2)10-5-3-4-7(10)8(9)11;/h3*9-10H,5-8H2,1-4H3;2*8-9,12H,4-7H2,1-3H3;3*8-10H,4-7H2,1-3H3;3*8-9H,4-7H2,1-3H3;2*6-7H,3-5H2,1-2H3,(H2,9,11);1H4/t2*10-;;4*9-;;2*9-;;2*7-;/m10.1010.10.10./s1.
What are the key properties of 2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2S)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-4-propan-2-ylmorpholine;(2S)-2-ethyl-4-propan-2-ylmorpholine;2-ethyl-4-propan-2-ylmorpholine;3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;methane;[(2R)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;[(2S)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;(2S)-1-propan-2-ylpyrrolidine-2-carboxamide;(2R)-1-propan-2-ylpyrrolidine-2-carboxamide?
2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2S)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-4-propan-2-ylmorpholine;(2S)-2-ethyl-4-propan-2-ylmorpholine;2-ethyl-4-propan-2-ylmorpholine;3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;methane;[(2R)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;[(2S)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;(2S)-1-propan-2-ylpyrrolidine-2-carboxamide;(2R)-1-propan-2-ylpyrrolidine-2-carboxamide has a molecular weight of 2124.53 g/mol, XLogP of 13.35, 26 rotatable bonds, 7 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2S)-2-ethyl-1-methyl-4-propan-2-ylpiperazine;(2R)-2-ethyl-4-propan-2-ylmorpholine;(2S)-2-ethyl-4-propan-2-ylmorpholine;2-ethyl-4-propan-2-ylmorpholine;3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;methane;[(2R)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;[(2S)-4-methyl-1-propan-2-ylpiperazin-2-yl]methanol;(2S)-1-propan-2-ylpyrrolidine-2-carboxamide;(2R)-1-propan-2-ylpyrrolidine-2-carboxamide is sourced from PubChem (CID 158761214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).