2,4-dimethylmorpholine;3,4-dimethylmorpholine;bis(2,3-dimethyloxane);2,4-dimethyloxane;2,5-dimethyloxane;2,6-dimethyloxane;1,2-dimethylpiperazine;1,3-dimethylpiperazine;1,2-dimethylpiperidine;tris(1,3-dimethylpiperidine);bis(1,4-dimethylpiperidine);bis(2,3-dimethylpiperidine);bis(2,4-dimethylpiperidine);bis(2,5-dimethylpiperidine);2,6-dimethylpiperidine;bis(3,4-dimethylpiperidine);3,5-dimethylpiperidine

C171H364N22O7 — CID 158572530

IUPAC2,4-dimethylmorpholine;3,4-dimethylmorpholine;bis(2,3-dimethyloxane);2,4-dimethyloxane;2,5-dimethyloxane;2,6-dimethyloxane;1,2-dimethylpiperazine;1,3-dimethylpiperazine;1,2-dimethylpiperidine;tris(1,3-dimethylpiperidine);bis(1,4-dimethylpiperidine);bis(2,3-dimethylpiperidine);bis(2,4-dimethylpiperidine);bis(2,5-dimethylpiperidine);2,6-dimethylpiperidine;bis(3,4-dimethylpiperidine);3,5-dimethylpiperidine
SMILESCC1CCC(C)NC1.CC1CCC(C)NC1.CC1CCC(C)OC1.CC1CCCC(C)N1.CC1CCCC(C)O1.CC1CCCCN1C.CC1CCCN(C)C1.CC1CCCN(C)C1.CC1CCCN(C)C1.CC1CCCNC1C.CC1CCCNC1C.CC1CCCOC1C.CC1CCCOC1C.CC1CCN(C)CC1.CC1CCN(C)CC1.CC1CCNC(C)C1.CC1CCNC(C)C1.CC1CCNCC1C.CC1CCNCC1C.CC1CCOC(C)C1.CC1CN(C)CCN1.CC1CN(C)CCO1.CC1CNCC(C)C1.CC1CNCCN1C.CC1COCCN1C
InChIInChI=1S/16C7H15N.5C7H14O.2C6H14N2.2C6H13NO/c1-6-3-7(2)5-8-4-6;2*1-7-3-5-8(2)6-4-7;2*1-6-3-4-8-5-7(6)2;2*1-6-3-4-8-7(2)5-6;2*1-6-3-4-7(2)8-5-6;3*1-7-4-3-5-8(2)6-7;1-7-5-3-4-6-8(7)2;2*1-6-4-3-5-8-7(6)2;1-6-4-3-5-7(2)8-6;1-6-3-4-8-7(2)5-6;1-6-3-4-7(2)8-5-6;2*1-6-4-3-5-8-7(6)2;1-6-4-3-5-7(2)8-6;1-6-5-8(2)4-3-7-6;1-6-5-7-3-4-8(6)2;1-6-5-8-4-3-7(6)2;1-6-5-7(2)3-4-8-6/h6-8H,3-5H2,1-2H3;2*7H,3-6H2,1-2H3;6*6-8H,3-5H2,1-2H3;4*7H,3-6H2,1-2H3;3*6-8H,3-5H2,1-2H3;7*6-7H,3-5H2,1-2H3;2*6H,3-5H2,1-2H3
InChIKeyHSGLMWHIORVWBK-UHFFFAOYSA-N
MW2840.94 g/mol
LogP31.63
Rot. Bonds

About 2,4-dimethylmorpholine;3,4-dimethylmorpholine;bis(2,3-dimethyloxane);2,4-dimethyloxane;2,5-dimethyloxane;2,6-dimethyloxane;1,2-dimethylpiperazine;1,3-dimethylpiperazine;1,2-dimethylpiperidine;tris(1,3-dimethylpiperidine);bis(1,4-dimethylpiperidine);bis(2,3-dimethylpiperidine);bis(2,4-dimethylpiperidine);bis(2,5-dimethylpiperidine);2,6-dimethylpiperidine;bis(3,4-dimethylpiperidine);3,5-dimethylpiperidine

2,4-dimethylmorpholine;3,4-dimethylmorpholine;bis(2,3-dimethyloxane);2,4-dimethyloxane;2,5-dimethyloxane;2,6-dimethyloxane;1,2-dimethylpiperazine;1,3-dimethylpiperazine;1,2-dimethylpiperidine;tris(1,3-dimethylpiperidine);bis(1,4-dimethylpiperidine);bis(2,3-dimethylpiperidine);bis(2,4-dimethylpiperidine);bis(2,5-dimethylpiperidine);2,6-dimethylpiperidine;bis(3,4-dimethylpiperidine);3,5-dimethylpiperidine (PubChem CID 158572530) has the molecular formula C171H364N22O7 and a molecular weight of 2840.94 g/mol. Its IUPAC name is 2,4-dimethylmorpholine;3,4-dimethylmorpholine;bis(2,3-dimethyloxane);2,4-dimethyloxane;2,5-dimethyloxane;2,6-dimethyloxane;1,2-dimethylpiperazine;1,3-dimethylpiperazine;1,2-dimethylpiperidine;tris(1,3-dimethylpiperidine);bis(1,4-dimethylpiperidine);bis(2,3-dimethylpiperidine);bis(2,4-dimethylpiperidine);bis(2,5-dimethylpiperidine);2,6-dimethylpiperidine;bis(3,4-dimethylpiperidine);3,5-dimethylpiperidine.

Molecular Properties

Compound Name2,4-dimethylmorpholine;3,4-dimethylmorpholine;bis(2,3-dimethyloxane);2,4-dimethyloxane;2,5-dimethyloxane;2,6-dimethyloxane;1,2-dimethylpiperazine;1,3-dimethylpiperazine;1,2-dimethylpiperidine;tris(1,3-dimethylpiperidine);bis(1,4-dimethylpiperidine);bis(2,3-dimethylpiperidine);bis(2,4-dimethylpiperidine);bis(2,5-dimethylpiperidine);2,6-dimethylpiperidine;bis(3,4-dimethylpiperidine);3,5-dimethylpiperidine
PubChem CID158572530
Molecular FormulaC171H364N22O7
Molecular Weight2840.94 g/mol
Exact Mass2838.88
IUPAC Name2,4-dimethylmorpholine;3,4-dimethylmorpholine;bis(2,3-dimethyloxane);2,4-dimethyloxane;2,5-dimethyloxane;2,6-dimethyloxane;1,2-dimethylpiperazine;1,3-dimethylpiperazine;1,2-dimethylpiperidine;tris(1,3-dimethylpiperidine);bis(1,4-dimethylpiperidine);bis(2,3-dimethylpiperidine);bis(2,4-dimethylpiperidine);bis(2,5-dimethylpiperidine);2,6-dimethylpiperidine;bis(3,4-dimethylpiperidine);3,5-dimethylpiperidine
SMILESCC1CCC(C)NC1.CC1CCC(C)NC1.CC1CCC(C)OC1.CC1CCCC(C)N1.CC1CCCC(C)O1.CC1CCCCN1C.CC1CCCN(C)C1.CC1CCCN(C)C1.CC1CCCN(C)C1.CC1CCCNC1C.CC1CCCNC1C.CC1CCCOC1C.CC1CCCOC1C.CC1CCN(C)CC1.CC1CCN(C)CC1.CC1CCNC(C)C1.CC1CCNC(C)C1.CC1CCNCC1C.CC1CCNCC1C.CC1CCOC(C)C1.CC1CN(C)CCN1.CC1CN(C)CCO1.CC1CNCC(C)C1.CC1CNCCN1C.CC1COCCN1C
InChIInChI=1S/16C7H15N.5C7H14O.2C6H14N2.2C6H13NO/c1-6-3-7(2)5-8-4-6;2*1-7-3-5-8(2)6-4-7;2*1-6-3-4-8-5-7(6)2;2*1-6-3-4-8-7(2)5-6;2*1-6-3-4-7(2)8-5-6;3*1-7-4-3-5-8(2)6-7;1-7-5-3-4-6-8(7)2;2*1-6-4-3-5-8-7(6)2;1-6-4-3-5-7(2)8-6;1-6-3-4-8-7(2)5-6;1-6-3-4-7(2)8-5-6;2*1-6-4-3-5-8-7(6)2;1-6-4-3-5-7(2)8-6;1-6-5-8(2)4-3-7-6;1-6-5-7-3-4-8(6)2;1-6-5-8-4-3-7(6)2;1-6-5-7(2)3-4-8-6/h6-8H,3-5H2,1-2H3;2*7H,3-6H2,1-2H3;6*6-8H,3-5H2,1-2H3;4*7H,3-6H2,1-2H3;3*6-8H,3-5H2,1-2H3;7*6-7H,3-5H2,1-2H3;2*6H,3-5H2,1-2H3
InChIKeyHSGLMWHIORVWBK-UHFFFAOYSA-N
XLogP31.63
TPSA241.37 Ų
H-Bond Donors12
H-Bond Acceptors29
Rotatable Bonds
Heavy Atoms200
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002840.94
LogP ≤ 531.63
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1029

Analyze 2,4-dimethylmorpholine;3,4-dimethylmorpholine;bis(2,3-dimethyloxane);2,4-dimethyloxane;2,5-dimethyloxane;2,6-dimethyloxane;1,2-dimethylpiperazine;1,3-dimethylpiperazine;1,2-dimethylpiperidine;tris(1,3-dimethylpiperidine);bis(1,4-dimethylpiperidine);bis(2,3-dimethylpiperidine);bis(2,4-dimethylpiperidine);bis(2,5-dimethylpiperidine);2,6-dimethylpiperidine;bis(3,4-dimethylpiperidine);3,5-dimethylpiperidine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethylmorpholine;3,4-dimethylmorpholine;bis(2,3-dimethyloxane);2,4-dimethyloxane;2,5-dimethyloxane;2,6-dimethyloxane;1,2-dimethylpiperazine;1,3-dimethylpiperazine;1,2-dimethylpiperidine;tris(1,3-dimethylpiperidine);bis(1,4-dimethylpiperidine);bis(2,3-dimethylpiperidine);bis(2,4-dimethylpiperidine);bis(2,5-dimethylpiperidine);2,6-dimethylpiperidine;bis(3,4-dimethylpiperidine);3,5-dimethylpiperidine?
The IUPAC name of 2,4-dimethylmorpholine;3,4-dimethylmorpholine;bis(2,3-dimethyloxane);2,4-dimethyloxane;2,5-dimethyloxane;2,6-dimethyloxane;1,2-dimethylpiperazine;1,3-dimethylpiperazine;1,2-dimethylpiperidine;tris(1,3-dimethylpiperidine);bis(1,4-dimethylpiperidine);bis(2,3-dimethylpiperidine);bis(2,4-dimethylpiperidine);bis(2,5-dimethylpiperidine);2,6-dimethylpiperidine;bis(3,4-dimethylpiperidine);3,5-dimethylpiperidine (CID 158572530) is 2,4-dimethylmorpholine;3,4-dimethylmorpholine;bis(2,3-dimethyloxane);2,4-dimethyloxane;2,5-dimethyloxane;2,6-dimethyloxane;1,2-dimethylpiperazine;1,3-dimethylpiperazine;1,2-dimethylpiperidine;tris(1,3-dimethylpiperidine);bis(1,4-dimethylpiperidine);bis(2,3-dimethylpiperidine);bis(2,4-dimethylpiperidine);bis(2,5-dimethylpiperidine);2,6-dimethylpiperidine;bis(3,4-dimethylpiperidine);3,5-dimethylpiperidine.
What is the SMILES notation for 2,4-dimethylmorpholine;3,4-dimethylmorpholine;bis(2,3-dimethyloxane);2,4-dimethyloxane;2,5-dimethyloxane;2,6-dimethyloxane;1,2-dimethylpiperazine;1,3-dimethylpiperazine;1,2-dimethylpiperidine;tris(1,3-dimethylpiperidine);bis(1,4-dimethylpiperidine);bis(2,3-dimethylpiperidine);bis(2,4-dimethylpiperidine);bis(2,5-dimethylpiperidine);2,6-dimethylpiperidine;bis(3,4-dimethylpiperidine);3,5-dimethylpiperidine?
The canonical SMILES for 2,4-dimethylmorpholine;3,4-dimethylmorpholine;bis(2,3-dimethyloxane);2,4-dimethyloxane;2,5-dimethyloxane;2,6-dimethyloxane;1,2-dimethylpiperazine;1,3-dimethylpiperazine;1,2-dimethylpiperidine;tris(1,3-dimethylpiperidine);bis(1,4-dimethylpiperidine);bis(2,3-dimethylpiperidine);bis(2,4-dimethylpiperidine);bis(2,5-dimethylpiperidine);2,6-dimethylpiperidine;bis(3,4-dimethylpiperidine);3,5-dimethylpiperidine is CC1CCC(C)NC1.CC1CCC(C)NC1.CC1CCC(C)OC1.CC1CCCC(C)N1.CC1CCCC(C)O1.CC1CCCCN1C.CC1CCCN(C)C1.CC1CCCN(C)C1.CC1CCCN(C)C1.CC1CCCNC1C.CC1CCCNC1C.CC1CCCOC1C.CC1CCCOC1C.CC1CCN(C)CC1.CC1CCN(C)CC1.CC1CCNC(C)C1.CC1CCNC(C)C1.CC1CCNCC1C.CC1CCNCC1C.CC1CCOC(C)C1.CC1CN(C)CCN1.CC1CN(C)CCO1.CC1CNCC(C)C1.CC1CNCCN1C.CC1COCCN1C.
What is the InChIKey of 2,4-dimethylmorpholine;3,4-dimethylmorpholine;bis(2,3-dimethyloxane);2,4-dimethyloxane;2,5-dimethyloxane;2,6-dimethyloxane;1,2-dimethylpiperazine;1,3-dimethylpiperazine;1,2-dimethylpiperidine;tris(1,3-dimethylpiperidine);bis(1,4-dimethylpiperidine);bis(2,3-dimethylpiperidine);bis(2,4-dimethylpiperidine);bis(2,5-dimethylpiperidine);2,6-dimethylpiperidine;bis(3,4-dimethylpiperidine);3,5-dimethylpiperidine?
The InChIKey is HSGLMWHIORVWBK-UHFFFAOYSA-N. The full InChI is InChI=1S/16C7H15N.5C7H14O.2C6H14N2.2C6H13NO/c1-6-3-7(2)5-8-4-6;2*1-7-3-5-8(2)6-4-7;2*1-6-3-4-8-5-7(6)2;2*1-6-3-4-8-7(2)5-6;2*1-6-3-4-7(2)8-5-6;3*1-7-4-3-5-8(2)6-7;1-7-5-3-4-6-8(7)2;2*1-6-4-3-5-8-7(6)2;1-6-4-3-5-7(2)8-6;1-6-3-4-8-7(2)5-6;1-6-3-4-7(2)8-5-6;2*1-6-4-3-5-8-7(6)2;1-6-4-3-5-7(2)8-6;1-6-5-8(2)4-3-7-6;1-6-5-7-3-4-8(6)2;1-6-5-8-4-3-7(6)2;1-6-5-7(2)3-4-8-6/h6-8H,3-5H2,1-2H3;2*7H,3-6H2,1-2H3;6*6-8H,3-5H2,1-2H3;4*7H,3-6H2,1-2H3;3*6-8H,3-5H2,1-2H3;7*6-7H,3-5H2,1-2H3;2*6H,3-5H2,1-2H3.
What are the key properties of 2,4-dimethylmorpholine;3,4-dimethylmorpholine;bis(2,3-dimethyloxane);2,4-dimethyloxane;2,5-dimethyloxane;2,6-dimethyloxane;1,2-dimethylpiperazine;1,3-dimethylpiperazine;1,2-dimethylpiperidine;tris(1,3-dimethylpiperidine);bis(1,4-dimethylpiperidine);bis(2,3-dimethylpiperidine);bis(2,4-dimethylpiperidine);bis(2,5-dimethylpiperidine);2,6-dimethylpiperidine;bis(3,4-dimethylpiperidine);3,5-dimethylpiperidine?
2,4-dimethylmorpholine;3,4-dimethylmorpholine;bis(2,3-dimethyloxane);2,4-dimethyloxane;2,5-dimethyloxane;2,6-dimethyloxane;1,2-dimethylpiperazine;1,3-dimethylpiperazine;1,2-dimethylpiperidine;tris(1,3-dimethylpiperidine);bis(1,4-dimethylpiperidine);bis(2,3-dimethylpiperidine);bis(2,4-dimethylpiperidine);bis(2,5-dimethylpiperidine);2,6-dimethylpiperidine;bis(3,4-dimethylpiperidine);3,5-dimethylpiperidine has a molecular weight of 2840.94 g/mol, XLogP of 31.63, 0 rotatable bonds, 12 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethylmorpholine;3,4-dimethylmorpholine;bis(2,3-dimethyloxane);2,4-dimethyloxane;2,5-dimethyloxane;2,6-dimethyloxane;1,2-dimethylpiperazine;1,3-dimethylpiperazine;1,2-dimethylpiperidine;tris(1,3-dimethylpiperidine);bis(1,4-dimethylpiperidine);bis(2,3-dimethylpiperidine);bis(2,4-dimethylpiperidine);bis(2,5-dimethylpiperidine);2,6-dimethylpiperidine;bis(3,4-dimethylpiperidine);3,5-dimethylpiperidine is sourced from PubChem (CID 158572530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).