2,2-dimethyl-4-propan-2-ylmorpholine;(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;1,2,2-trimethyl-4-propan-2-ylpiperazine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one

C113H245N17O4 — CID 157247075

About 2,2-dimethyl-4-propan-2-ylmorpholine;(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;1,2,2-trimethyl-4-propan-2-ylpiperazine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one

2,2-dimethyl-4-propan-2-ylmorpholine;(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;1,2,2-trimethyl-4-propan-2-ylpiperazine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one (PubChem CID 157247075) has the molecular formula C113H245N17O4 and a molecular weight of 1906.32 g/mol. Its IUPAC name is 2,2-dimethyl-4-propan-2-ylmorpholine;(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;1,2,2-trimethyl-4-propan-2-ylpiperazine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one.

Molecular Properties

• Compound Name: 2,2-dimethyl-4-propan-2-ylmorpholine;(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;1,2,2-trimethyl-4-propan-2-ylpiperazine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one
• PubChem CID: 157247075
• Molecular Formula: C113H245N17O4
• Molecular Weight: 1906.32 g/mol
• Exact Mass: 1904.95
• IUPAC Name: 2,2-dimethyl-4-propan-2-ylmorpholine;(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;1,2,2-trimethyl-4-propan-2-ylpiperazine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one
• SMILES: C.C.CC(C)N1CC(=O)N(C)CC1(C)C.CC(C)N1CCCCC1(C)C.CC(C)N1CCCCC1(C)C.CC(C)N1CCC[C@@H](C)C1.CC(C)N1CCC[C@H](C)C1.CC(C)N1CCN(C)C(C)(C)C1.CC(C)N1CCN(C)CC1(C)C.CC(C)N1CCN(C)[C@@H](C)C1.CC(C)N1CCN(C)[C@H](C)C1.CC(C)N1CCOC(C)(C)C1.CC(C)N1CCO[C@@H](C)C1.CC(C)N1CCO[C@H](C)C1
• InChI: InChI=1S/C10H20N2O.2C10H22N2.2C10H21N.2C9H20N2.C9H19NO.2C9H19N.2C8H17NO.2CH4/c1-8(2)12-6-9(13)11(5)7-10(12,3)4;1-9(2)12-7-6-11(5)10(3,4)8-12;1-9(2)12-7-6-11(5)8-10(12,3)4;2*1-9(2)11-8-6-5-7-10(11,3)4;2*1-8(2)11-6-5-10(4)9(3)7-11;1-8(2)10-5-6-11-9(3,4)7-10;2*1-8(2)10-6-4-5-9(3)7-10;2*1-7(2)9-4-5-10-8(3)6-9;;/h8H,6-7H2,1-5H3;2*9H,6-8H2,1-5H3;2*9H,5-8H2,1-4H3;2*8-9H,5-7H2,1-4H3;8H,5-7H2,1-4H3;2*8-9H,4-7H2,1-3H3;2*7-8H,4-6H2,1-3H3;2*1H4/t;;;;;2*9-;;2*9-;2*8-;;/m.....10.1010../s1
• InChIKey: AVXGJPBANYMZMI-FZTSMPCDSA-N
• XLogP: 20.43
• TPSA: 99.84 Ų
• H-Bond Acceptors: 20
• Rotatable Bonds: 12
• Heavy Atoms: 134
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1906.32
LogP ≤ 5	20.43
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	20

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-4-propan-2-ylmorpholine;(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;1,2,2-trimethyl-4-propan-2-ylpiperazine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one?

The IUPAC name of 2,2-dimethyl-4-propan-2-ylmorpholine;(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;1,2,2-trimethyl-4-propan-2-ylpiperazine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one (CID 157247075) is 2,2-dimethyl-4-propan-2-ylmorpholine;(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;1,2,2-trimethyl-4-propan-2-ylpiperazine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one.

What is the SMILES notation for 2,2-dimethyl-4-propan-2-ylmorpholine;(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;1,2,2-trimethyl-4-propan-2-ylpiperazine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one?

The canonical SMILES for 2,2-dimethyl-4-propan-2-ylmorpholine;(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;1,2,2-trimethyl-4-propan-2-ylpiperazine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one is C.C.CC(C)N1CC(=O)N(C)CC1(C)C.CC(C)N1CCCCC1(C)C.CC(C)N1CCCCC1(C)C.CC(C)N1CCC[C@@H](C)C1.CC(C)N1CCC[C@H](C)C1.CC(C)N1CCN(C)C(C)(C)C1.CC(C)N1CCN(C)CC1(C)C.CC(C)N1CCN(C)[C@@H](C)C1.CC(C)N1CCN(C)[C@H](C)C1.CC(C)N1CCOC(C)(C)C1.CC(C)N1CCO[C@@H](C)C1.CC(C)N1CCO[C@H](C)C1.

What is the InChIKey of 2,2-dimethyl-4-propan-2-ylmorpholine;(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;1,2,2-trimethyl-4-propan-2-ylpiperazine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one?

The InChIKey is AVXGJPBANYMZMI-FZTSMPCDSA-N. The full InChI is InChI=1S/C10H20N2O.2C10H22N2.2C10H21N.2C9H20N2.C9H19NO.2C9H19N.2C8H17NO.2CH4/c1-8(2)12-6-9(13)11(5)7-10(12,3)4;1-9(2)12-7-6-11(5)10(3,4)8-12;1-9(2)12-7-6-11(5)8-10(12,3)4;2*1-9(2)11-8-6-5-7-10(11,3)4;2*1-8(2)11-6-5-10(4)9(3)7-11;1-8(2)10-5-6-11-9(3,4)7-10;2*1-8(2)10-6-4-5-9(3)7-10;2*1-7(2)9-4-5-10-8(3)6-9;;/h8H,6-7H2,1-5H3;2*9H,6-8H2,1-5H3;2*9H,5-8H2,1-4H3;2*8-9H,5-7H2,1-4H3;8H,5-7H2,1-4H3;2*8-9H,4-7H2,1-3H3;2*7-8H,4-6H2,1-3H3;2*1H4/t;;;;;2*9-;;2*9-;2*8-;;/m.....10.1010../s1.

What are the key properties of 2,2-dimethyl-4-propan-2-ylmorpholine;(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;1,2,2-trimethyl-4-propan-2-ylpiperazine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one?

2,2-dimethyl-4-propan-2-ylmorpholine;(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;1,2,2-trimethyl-4-propan-2-ylpiperazine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one has a molecular weight of 1906.32 g/mol, XLogP of 20.43, 12 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 2,2-dimethyl-4-propan-2-ylmorpholine;(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;1,2,2-trimethyl-4-propan-2-ylpiperazine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one is sourced from PubChem (CID 157247075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).