1-(1,1-dideuterio-2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,5-dimethyl-3,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethyl-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethylmorpholine;1-(2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,2,6,6-tetramethylmorpholine;4-(2,2-dimethylpropyl)-2,3,5,6-tetramethylmorpholine;2,2,3,3,5,5,6-heptadeuterio-4-(1,1-dideuterio-2,2-dimethylpropyl)-6-methylmorpholine;methane;2,2,3,3,5,5,6,6-octadeuterio-4-(2,2-dimethylpropyl)morpholine

C114H240N10O8 — CID 157064350

IUPAC1-(1,1-dideuterio-2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,5-dimethyl-3,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethyl-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethylmorpholine;1-(2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,2,6,6-tetramethylmorpholine;4-(2,2-dimethylpropyl)-2,3,5,6-tetramethylmorpholine;2,2,3,3,5,5,6-heptadeuterio-4-(1,1-dideuterio-2,2-dimethylpropyl)-6-methylmorpholine;methane;2,2,3,3,5,5,6,6-octadeuterio-4-(2,2-dimethylpropyl)morpholine
SMILESC.CC(C)(C)CN1CC(C)(C)OC(C)(C)C1.CC(C)(C)CN1CCCCC1.CC1CN(CC(C)(C)C)CC(C)O1.CC1OC(C)C(C)N(CC(C)(C)C)C1C.[2H]C([2H])(N1CCCCC1)C(C)(C)C.[2H]C([2H])([2H])C1(C)CN(CC(C)(C)C)CC(C)(C([2H])([2H])[2H])O1.[2H]C([2H])([2H])C1CN(CC(C)(C)C)CC(C([2H])([2H])[2H])O1.[2H]C([2H])([2H])C1OC(C)C(C([2H])([2H])[2H])N(CC(C)(C)C)C1C.[2H]C1([2H])OC([2H])(C)C([2H])([2H])N(C([2H])([2H])C(C)(C)C)C1([2H])[2H].[2H]C1([2H])OC([2H])([2H])C([2H])([2H])N(CC(C)(C)C)C1([2H])[2H]
InChIInChI=1S/4C13H27NO.2C11H23NO.C10H21NO.2C10H21N.C9H19NO.CH4/c2*1-11(2,3)8-14-9-12(4,5)15-13(6,7)10-14;2*1-9-11(3)15-12(4)10(2)14(9)8-13(5,6)7;2*1-9-6-12(7-10(2)13-9)8-11(3,4)5;1-9-7-11(5-6-12-9)8-10(2,3)4;2*1-10(2,3)9-11-7-5-4-6-8-11;1-9(2,3)8-10-4-6-11-7-5-10;/h2*8-10H2,1-7H3;2*9-12H,8H2,1-7H3;2*9-10H,6-8H2,1-5H3;9H,5-8H2,1-4H3;2*4-9H2,1-3H3;4-8H2,1-3H3;1H4/i4D3,6D3;;1D3,4D3;;1D3,2D3;;5D2,6D2,7D2,8D2,9D;9D2;;4D2,5D2,6D2,7D2;
InChIKeyABRURGNVQUUZAN-XOVFPEIXSA-N
MW1916.46 g/mol
LogP24.76
Rot. Bonds16

About 1-(1,1-dideuterio-2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,5-dimethyl-3,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethyl-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethylmorpholine;1-(2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,2,6,6-tetramethylmorpholine;4-(2,2-dimethylpropyl)-2,3,5,6-tetramethylmorpholine;2,2,3,3,5,5,6-heptadeuterio-4-(1,1-dideuterio-2,2-dimethylpropyl)-6-methylmorpholine;methane;2,2,3,3,5,5,6,6-octadeuterio-4-(2,2-dimethylpropyl)morpholine

1-(1,1-dideuterio-2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,5-dimethyl-3,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethyl-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethylmorpholine;1-(2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,2,6,6-tetramethylmorpholine;4-(2,2-dimethylpropyl)-2,3,5,6-tetramethylmorpholine;2,2,3,3,5,5,6-heptadeuterio-4-(1,1-dideuterio-2,2-dimethylpropyl)-6-methylmorpholine;methane;2,2,3,3,5,5,6,6-octadeuterio-4-(2,2-dimethylpropyl)morpholine (PubChem CID 157064350) has the molecular formula C114H240N10O8 and a molecular weight of 1916.46 g/mol. Its IUPAC name is 1-(1,1-dideuterio-2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,5-dimethyl-3,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethyl-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethylmorpholine;1-(2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,2,6,6-tetramethylmorpholine;4-(2,2-dimethylpropyl)-2,3,5,6-tetramethylmorpholine;2,2,3,3,5,5,6-heptadeuterio-4-(1,1-dideuterio-2,2-dimethylpropyl)-6-methylmorpholine;methane;2,2,3,3,5,5,6,6-octadeuterio-4-(2,2-dimethylpropyl)morpholine.

Molecular Properties

Compound Name1-(1,1-dideuterio-2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,5-dimethyl-3,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethyl-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethylmorpholine;1-(2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,2,6,6-tetramethylmorpholine;4-(2,2-dimethylpropyl)-2,3,5,6-tetramethylmorpholine;2,2,3,3,5,5,6-heptadeuterio-4-(1,1-dideuterio-2,2-dimethylpropyl)-6-methylmorpholine;methane;2,2,3,3,5,5,6,6-octadeuterio-4-(2,2-dimethylpropyl)morpholine
PubChem CID157064350
Molecular FormulaC114H240N10O8
Molecular Weight1916.46 g/mol
Exact Mass1915.10
IUPAC Name1-(1,1-dideuterio-2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,5-dimethyl-3,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethyl-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethylmorpholine;1-(2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,2,6,6-tetramethylmorpholine;4-(2,2-dimethylpropyl)-2,3,5,6-tetramethylmorpholine;2,2,3,3,5,5,6-heptadeuterio-4-(1,1-dideuterio-2,2-dimethylpropyl)-6-methylmorpholine;methane;2,2,3,3,5,5,6,6-octadeuterio-4-(2,2-dimethylpropyl)morpholine
SMILESC.CC(C)(C)CN1CC(C)(C)OC(C)(C)C1.CC(C)(C)CN1CCCCC1.CC1CN(CC(C)(C)C)CC(C)O1.CC1OC(C)C(C)N(CC(C)(C)C)C1C.[2H]C([2H])(N1CCCCC1)C(C)(C)C.[2H]C([2H])([2H])C1(C)CN(CC(C)(C)C)CC(C)(C([2H])([2H])[2H])O1.[2H]C([2H])([2H])C1CN(CC(C)(C)C)CC(C([2H])([2H])[2H])O1.[2H]C([2H])([2H])C1OC(C)C(C([2H])([2H])[2H])N(CC(C)(C)C)C1C.[2H]C1([2H])OC([2H])(C)C([2H])([2H])N(C([2H])([2H])C(C)(C)C)C1([2H])[2H].[2H]C1([2H])OC([2H])([2H])C([2H])([2H])N(CC(C)(C)C)C1([2H])[2H]
InChIInChI=1S/4C13H27NO.2C11H23NO.C10H21NO.2C10H21N.C9H19NO.CH4/c2*1-11(2,3)8-14-9-12(4,5)15-13(6,7)10-14;2*1-9-11(3)15-12(4)10(2)14(9)8-13(5,6)7;2*1-9-6-12(7-10(2)13-9)8-11(3,4)5;1-9-7-11(5-6-12-9)8-10(2,3)4;2*1-10(2,3)9-11-7-5-4-6-8-11;1-9(2,3)8-10-4-6-11-7-5-10;/h2*8-10H2,1-7H3;2*9-12H,8H2,1-7H3;2*9-10H,6-8H2,1-5H3;9H,5-8H2,1-4H3;2*4-9H2,1-3H3;4-8H2,1-3H3;1H4/i4D3,6D3;;1D3,4D3;;1D3,2D3;;5D2,6D2,7D2,8D2,9D;9D2;;4D2,5D2,6D2,7D2;
InChIKeyABRURGNVQUUZAN-XOVFPEIXSA-N
XLogP24.76
TPSA106.24 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds16
Heavy Atoms132
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001916.46
LogP ≤ 524.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze 1-(1,1-dideuterio-2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,5-dimethyl-3,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethyl-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethylmorpholine;1-(2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,2,6,6-tetramethylmorpholine;4-(2,2-dimethylpropyl)-2,3,5,6-tetramethylmorpholine;2,2,3,3,5,5,6-heptadeuterio-4-(1,1-dideuterio-2,2-dimethylpropyl)-6-methylmorpholine;methane;2,2,3,3,5,5,6,6-octadeuterio-4-(2,2-dimethylpropyl)morpholine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-(1,1-dideuterio-2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,5-dimethyl-3,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethyl-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethylmorpholine;1-(2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,2,6,6-tetramethylmorpholine;4-(2,2-dimethylpropyl)-2,3,5,6-tetramethylmorpholine;2,2,3,3,5,5,6-heptadeuterio-4-(1,1-dideuterio-2,2-dimethylpropyl)-6-methylmorpholine;methane;2,2,3,3,5,5,6,6-octadeuterio-4-(2,2-dimethylpropyl)morpholine?
The IUPAC name of 1-(1,1-dideuterio-2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,5-dimethyl-3,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethyl-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethylmorpholine;1-(2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,2,6,6-tetramethylmorpholine;4-(2,2-dimethylpropyl)-2,3,5,6-tetramethylmorpholine;2,2,3,3,5,5,6-heptadeuterio-4-(1,1-dideuterio-2,2-dimethylpropyl)-6-methylmorpholine;methane;2,2,3,3,5,5,6,6-octadeuterio-4-(2,2-dimethylpropyl)morpholine (CID 157064350) is 1-(1,1-dideuterio-2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,5-dimethyl-3,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethyl-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethylmorpholine;1-(2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,2,6,6-tetramethylmorpholine;4-(2,2-dimethylpropyl)-2,3,5,6-tetramethylmorpholine;2,2,3,3,5,5,6-heptadeuterio-4-(1,1-dideuterio-2,2-dimethylpropyl)-6-methylmorpholine;methane;2,2,3,3,5,5,6,6-octadeuterio-4-(2,2-dimethylpropyl)morpholine.
What is the SMILES notation for 1-(1,1-dideuterio-2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,5-dimethyl-3,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethyl-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethylmorpholine;1-(2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,2,6,6-tetramethylmorpholine;4-(2,2-dimethylpropyl)-2,3,5,6-tetramethylmorpholine;2,2,3,3,5,5,6-heptadeuterio-4-(1,1-dideuterio-2,2-dimethylpropyl)-6-methylmorpholine;methane;2,2,3,3,5,5,6,6-octadeuterio-4-(2,2-dimethylpropyl)morpholine?
The canonical SMILES for 1-(1,1-dideuterio-2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,5-dimethyl-3,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethyl-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethylmorpholine;1-(2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,2,6,6-tetramethylmorpholine;4-(2,2-dimethylpropyl)-2,3,5,6-tetramethylmorpholine;2,2,3,3,5,5,6-heptadeuterio-4-(1,1-dideuterio-2,2-dimethylpropyl)-6-methylmorpholine;methane;2,2,3,3,5,5,6,6-octadeuterio-4-(2,2-dimethylpropyl)morpholine is C.CC(C)(C)CN1CC(C)(C)OC(C)(C)C1.CC(C)(C)CN1CCCCC1.CC1CN(CC(C)(C)C)CC(C)O1.CC1OC(C)C(C)N(CC(C)(C)C)C1C.[2H]C([2H])(N1CCCCC1)C(C)(C)C.[2H]C([2H])([2H])C1(C)CN(CC(C)(C)C)CC(C)(C([2H])([2H])[2H])O1.[2H]C([2H])([2H])C1CN(CC(C)(C)C)CC(C([2H])([2H])[2H])O1.[2H]C([2H])([2H])C1OC(C)C(C([2H])([2H])[2H])N(CC(C)(C)C)C1C.[2H]C1([2H])OC([2H])(C)C([2H])([2H])N(C([2H])([2H])C(C)(C)C)C1([2H])[2H].[2H]C1([2H])OC([2H])([2H])C([2H])([2H])N(CC(C)(C)C)C1([2H])[2H].
What is the InChIKey of 1-(1,1-dideuterio-2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,5-dimethyl-3,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethyl-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethylmorpholine;1-(2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,2,6,6-tetramethylmorpholine;4-(2,2-dimethylpropyl)-2,3,5,6-tetramethylmorpholine;2,2,3,3,5,5,6-heptadeuterio-4-(1,1-dideuterio-2,2-dimethylpropyl)-6-methylmorpholine;methane;2,2,3,3,5,5,6,6-octadeuterio-4-(2,2-dimethylpropyl)morpholine?
The InChIKey is ABRURGNVQUUZAN-XOVFPEIXSA-N. The full InChI is InChI=1S/4C13H27NO.2C11H23NO.C10H21NO.2C10H21N.C9H19NO.CH4/c2*1-11(2,3)8-14-9-12(4,5)15-13(6,7)10-14;2*1-9-11(3)15-12(4)10(2)14(9)8-13(5,6)7;2*1-9-6-12(7-10(2)13-9)8-11(3,4)5;1-9-7-11(5-6-12-9)8-10(2,3)4;2*1-10(2,3)9-11-7-5-4-6-8-11;1-9(2,3)8-10-4-6-11-7-5-10;/h2*8-10H2,1-7H3;2*9-12H,8H2,1-7H3;2*9-10H,6-8H2,1-5H3;9H,5-8H2,1-4H3;2*4-9H2,1-3H3;4-8H2,1-3H3;1H4/i4D3,6D3;;1D3,4D3;;1D3,2D3;;5D2,6D2,7D2,8D2,9D;9D2;;4D2,5D2,6D2,7D2;.
What are the key properties of 1-(1,1-dideuterio-2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,5-dimethyl-3,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethyl-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethylmorpholine;1-(2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,2,6,6-tetramethylmorpholine;4-(2,2-dimethylpropyl)-2,3,5,6-tetramethylmorpholine;2,2,3,3,5,5,6-heptadeuterio-4-(1,1-dideuterio-2,2-dimethylpropyl)-6-methylmorpholine;methane;2,2,3,3,5,5,6,6-octadeuterio-4-(2,2-dimethylpropyl)morpholine?
1-(1,1-dideuterio-2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,5-dimethyl-3,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethyl-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethylmorpholine;1-(2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,2,6,6-tetramethylmorpholine;4-(2,2-dimethylpropyl)-2,3,5,6-tetramethylmorpholine;2,2,3,3,5,5,6-heptadeuterio-4-(1,1-dideuterio-2,2-dimethylpropyl)-6-methylmorpholine;methane;2,2,3,3,5,5,6,6-octadeuterio-4-(2,2-dimethylpropyl)morpholine has a molecular weight of 1916.46 g/mol, XLogP of 24.76, 16 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,1-dideuterio-2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,5-dimethyl-3,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethyl-2,6-bis(trideuteriomethyl)morpholine;4-(2,2-dimethylpropyl)-2,6-dimethylmorpholine;1-(2,2-dimethylpropyl)piperidine;4-(2,2-dimethylpropyl)-2,2,6,6-tetramethylmorpholine;4-(2,2-dimethylpropyl)-2,3,5,6-tetramethylmorpholine;2,2,3,3,5,5,6-heptadeuterio-4-(1,1-dideuterio-2,2-dimethylpropyl)-6-methylmorpholine;methane;2,2,3,3,5,5,6,6-octadeuterio-4-(2,2-dimethylpropyl)morpholine is sourced from PubChem (CID 157064350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).