bis((3S,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine);bis((3R,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine)

C184H356N12 — CID 158296640

IUPACbis((3S,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine);bis((3R,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine)
SMILESCC(C)CC[C@@H]1CCN(C2CCC2)C[C@@H]1C(C)C.CC(C)CC[C@@H]1CCN(C2CCC2)C[C@@H]1C(C)C.CC(C)CC[C@@H]1CCN(C2CCC2)C[C@H]1C(C)C.CC(C)CC[C@@H]1CCN(C2CCC2)C[C@H]1C(C)C.CCC[C@@H]1CCN(C2CCC2)C[C@@H]1C(C)C.CCC[C@@H]1CCN(C2CCC2)C[C@@H]1C(C)C.CCC[C@@H]1CCN(C2CCC2)C[C@H]1C(C)C.CCC[C@@H]1CCN(C2CCC2)C[C@H]1C(C)C.CC[C@@H]1CCN(C2CCC2)C[C@@H]1C(C)C.CC[C@@H]1CCN(C2CCC2)C[C@@H]1C(C)C.CC[C@@H]1CCN(C2CCC2)C[C@H]1C(C)C.CC[C@@H]1CCN(C2CCC2)C[C@H]1C(C)C
InChIInChI=1S/4C17H33N.4C15H29N.4C14H27N/c4*1-13(2)8-9-15-10-11-18(16-6-5-7-16)12-17(15)14(3)4;4*1-4-6-13-9-10-16(14-7-5-8-14)11-15(13)12(2)3;4*1-4-12-8-9-15(13-6-5-7-13)10-14(12)11(2)3/h4*13-17H,5-12H2,1-4H3;4*12-15H,4-11H2,1-3H3;4*11-14H,4-10H2,1-3H3/t2*15-,17+;2*15-,17-;2*13-,15+;2*13-,15-;2*12-,14+;2*12-,14-/m111111111111/s1
InChIKeyGLZMHMHADXHWDH-LAXZYTHNSA-N
MW2736.96 g/mol
LogP48.18
Rot. Bonds48

About bis((3S,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine);bis((3R,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine)

bis((3S,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine);bis((3R,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine) (PubChem CID 158296640) has the molecular formula C184H356N12 and a molecular weight of 2736.96 g/mol. Its IUPAC name is bis((3S,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine);bis((3R,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine).

Molecular Properties

Compound Namebis((3S,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine);bis((3R,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine)
PubChem CID158296640
Molecular FormulaC184H356N12
Molecular Weight2736.96 g/mol
Exact Mass2734.82
IUPAC Namebis((3S,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine);bis((3R,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine)
SMILESCC(C)CC[C@@H]1CCN(C2CCC2)C[C@@H]1C(C)C.CC(C)CC[C@@H]1CCN(C2CCC2)C[C@@H]1C(C)C.CC(C)CC[C@@H]1CCN(C2CCC2)C[C@H]1C(C)C.CC(C)CC[C@@H]1CCN(C2CCC2)C[C@H]1C(C)C.CCC[C@@H]1CCN(C2CCC2)C[C@@H]1C(C)C.CCC[C@@H]1CCN(C2CCC2)C[C@@H]1C(C)C.CCC[C@@H]1CCN(C2CCC2)C[C@H]1C(C)C.CCC[C@@H]1CCN(C2CCC2)C[C@H]1C(C)C.CC[C@@H]1CCN(C2CCC2)C[C@@H]1C(C)C.CC[C@@H]1CCN(C2CCC2)C[C@@H]1C(C)C.CC[C@@H]1CCN(C2CCC2)C[C@H]1C(C)C.CC[C@@H]1CCN(C2CCC2)C[C@H]1C(C)C
InChIInChI=1S/4C17H33N.4C15H29N.4C14H27N/c4*1-13(2)8-9-15-10-11-18(16-6-5-7-16)12-17(15)14(3)4;4*1-4-6-13-9-10-16(14-7-5-8-14)11-15(13)12(2)3;4*1-4-12-8-9-15(13-6-5-7-13)10-14(12)11(2)3/h4*13-17H,5-12H2,1-4H3;4*12-15H,4-11H2,1-3H3;4*11-14H,4-10H2,1-3H3/t2*15-,17+;2*15-,17-;2*13-,15+;2*13-,15-;2*12-,14+;2*12-,14-/m111111111111/s1
InChIKeyGLZMHMHADXHWDH-LAXZYTHNSA-N
XLogP48.18
TPSA38.88 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds48
Heavy Atoms196
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002736.96
LogP ≤ 548.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze bis((3S,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine);bis((3R,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine) with MolForge

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Frequently Asked Questions

What is the IUPAC name of bis((3S,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine);bis((3R,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine)?
The IUPAC name of bis((3S,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine);bis((3R,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine) (CID 158296640) is bis((3S,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine);bis((3R,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine).
What is the SMILES notation for bis((3S,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine);bis((3R,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine)?
The canonical SMILES for bis((3S,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine);bis((3R,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine) is CC(C)CC[C@@H]1CCN(C2CCC2)C[C@@H]1C(C)C.CC(C)CC[C@@H]1CCN(C2CCC2)C[C@@H]1C(C)C.CC(C)CC[C@@H]1CCN(C2CCC2)C[C@H]1C(C)C.CC(C)CC[C@@H]1CCN(C2CCC2)C[C@H]1C(C)C.CCC[C@@H]1CCN(C2CCC2)C[C@@H]1C(C)C.CCC[C@@H]1CCN(C2CCC2)C[C@@H]1C(C)C.CCC[C@@H]1CCN(C2CCC2)C[C@H]1C(C)C.CCC[C@@H]1CCN(C2CCC2)C[C@H]1C(C)C.CC[C@@H]1CCN(C2CCC2)C[C@@H]1C(C)C.CC[C@@H]1CCN(C2CCC2)C[C@@H]1C(C)C.CC[C@@H]1CCN(C2CCC2)C[C@H]1C(C)C.CC[C@@H]1CCN(C2CCC2)C[C@H]1C(C)C.
What is the InChIKey of bis((3S,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine);bis((3R,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine)?
The InChIKey is GLZMHMHADXHWDH-LAXZYTHNSA-N. The full InChI is InChI=1S/4C17H33N.4C15H29N.4C14H27N/c4*1-13(2)8-9-15-10-11-18(16-6-5-7-16)12-17(15)14(3)4;4*1-4-6-13-9-10-16(14-7-5-8-14)11-15(13)12(2)3;4*1-4-12-8-9-15(13-6-5-7-13)10-14(12)11(2)3/h4*13-17H,5-12H2,1-4H3;4*12-15H,4-11H2,1-3H3;4*11-14H,4-10H2,1-3H3/t2*15-,17+;2*15-,17-;2*13-,15+;2*13-,15-;2*12-,14+;2*12-,14-/m111111111111/s1.
What are the key properties of bis((3S,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine);bis((3R,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine)?
bis((3S,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine);bis((3R,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine) has a molecular weight of 2736.96 g/mol, XLogP of 48.18, 48 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for bis((3S,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3R,4R)-1-cyclobutyl-4-(3-methylbutyl)-3-propan-2-ylpiperidine);bis((3S,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine);bis((3R,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine) is sourced from PubChem (CID 158296640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).