bis(1,4-ditert-butyl-2,2-dimethylpiperazine);bis(1,4-ditert-butyl-2,2-dimethylpiperidine);bis(1,4-ditert-butyl-3,3-dimethylpiperidine);bis((2S)-1,4-ditert-butyl-2-methylpiperazine);bis((2R)-1,4-ditert-butyl-2-methylpiperazine);bis((2S)-1,4-ditert-butyl-2-methylpiperidine);bis((2R)-1,4-ditert-butyl-2-methylpiperidine);bis((3S)-1,4-ditert-butyl-3-methylpiperidine);bis((3R)-1,4-ditert-butyl-3-methylpiperidine)

C252H528N24 — CID 158962024

IUPACbis(1,4-ditert-butyl-2,2-dimethylpiperazine);bis(1,4-ditert-butyl-2,2-dimethylpiperidine);bis(1,4-ditert-butyl-3,3-dimethylpiperidine);bis((2S)-1,4-ditert-butyl-2-methylpiperazine);bis((2R)-1,4-ditert-butyl-2-methylpiperazine);bis((2S)-1,4-ditert-butyl-2-methylpiperidine);bis((2R)-1,4-ditert-butyl-2-methylpiperidine);bis((3S)-1,4-ditert-butyl-3-methylpiperidine);bis((3R)-1,4-ditert-butyl-3-methylpiperidine)
SMILESCC(C)(C)C1CCN(C(C)(C)C)C(C)(C)C1.CC(C)(C)C1CCN(C(C)(C)C)C(C)(C)C1.CC(C)(C)C1CCN(C(C)(C)C)CC1(C)C.CC(C)(C)C1CCN(C(C)(C)C)CC1(C)C.CC(C)(C)N1CCN(C(C)(C)C)C(C)(C)C1.CC(C)(C)N1CCN(C(C)(C)C)C(C)(C)C1.C[C@@H]1CC(C(C)(C)C)CCN1C(C)(C)C.C[C@@H]1CC(C(C)(C)C)CCN1C(C)(C)C.C[C@@H]1CN(C(C)(C)C)CCC1C(C)(C)C.C[C@@H]1CN(C(C)(C)C)CCC1C(C)(C)C.C[C@@H]1CN(C(C)(C)C)CCN1C(C)(C)C.C[C@@H]1CN(C(C)(C)C)CCN1C(C)(C)C.C[C@H]1CC(C(C)(C)C)CCN1C(C)(C)C.C[C@H]1CC(C(C)(C)C)CCN1C(C)(C)C.C[C@H]1CN(C(C)(C)C)CCC1C(C)(C)C.C[C@H]1CN(C(C)(C)C)CCC1C(C)(C)C.C[C@H]1CN(C(C)(C)C)CCN1C(C)(C)C.C[C@H]1CN(C(C)(C)C)CCN1C(C)(C)C
InChIInChI=1S/4C15H31N.2C14H30N2.8C14H29N.4C13H28N2/c2*1-13(2,3)12-9-10-16(14(4,5)6)11-15(12,7)8;2*1-13(2,3)12-9-10-16(14(4,5)6)15(7,8)11-12;2*1-12(2,3)15-9-10-16(13(4,5)6)14(7,8)11-15;4*1-11-10-15(14(5,6)7)9-8-12(11)13(2,3)4;4*1-11-10-12(13(2,3)4)8-9-15(11)14(5,6)7;4*1-11-10-14(12(2,3)4)8-9-15(11)13(5,6)7/h4*12H,9-11H2,1-8H3;2*9-11H2,1-8H3;8*11-12H,8-10H2,1-7H3;4*11H,8-10H2,1-7H3/t;;;;;;8*11-,12?;4*11-/m......110011001100/s1
InChIKeyJMSWHUJCZFLFEL-LEKCXDFQSA-N
MW3895.16 g/mol
LogP64.20
Rot. Bonds

About bis(1,4-ditert-butyl-2,2-dimethylpiperazine);bis(1,4-ditert-butyl-2,2-dimethylpiperidine);bis(1,4-ditert-butyl-3,3-dimethylpiperidine);bis((2S)-1,4-ditert-butyl-2-methylpiperazine);bis((2R)-1,4-ditert-butyl-2-methylpiperazine);bis((2S)-1,4-ditert-butyl-2-methylpiperidine);bis((2R)-1,4-ditert-butyl-2-methylpiperidine);bis((3S)-1,4-ditert-butyl-3-methylpiperidine);bis((3R)-1,4-ditert-butyl-3-methylpiperidine)

bis(1,4-ditert-butyl-2,2-dimethylpiperazine);bis(1,4-ditert-butyl-2,2-dimethylpiperidine);bis(1,4-ditert-butyl-3,3-dimethylpiperidine);bis((2S)-1,4-ditert-butyl-2-methylpiperazine);bis((2R)-1,4-ditert-butyl-2-methylpiperazine);bis((2S)-1,4-ditert-butyl-2-methylpiperidine);bis((2R)-1,4-ditert-butyl-2-methylpiperidine);bis((3S)-1,4-ditert-butyl-3-methylpiperidine);bis((3R)-1,4-ditert-butyl-3-methylpiperidine) (PubChem CID 158962024) has the molecular formula C252H528N24 and a molecular weight of 3895.16 g/mol. Its IUPAC name is bis(1,4-ditert-butyl-2,2-dimethylpiperazine);bis(1,4-ditert-butyl-2,2-dimethylpiperidine);bis(1,4-ditert-butyl-3,3-dimethylpiperidine);bis((2S)-1,4-ditert-butyl-2-methylpiperazine);bis((2R)-1,4-ditert-butyl-2-methylpiperazine);bis((2S)-1,4-ditert-butyl-2-methylpiperidine);bis((2R)-1,4-ditert-butyl-2-methylpiperidine);bis((3S)-1,4-ditert-butyl-3-methylpiperidine);bis((3R)-1,4-ditert-butyl-3-methylpiperidine).

Molecular Properties

Compound Namebis(1,4-ditert-butyl-2,2-dimethylpiperazine);bis(1,4-ditert-butyl-2,2-dimethylpiperidine);bis(1,4-ditert-butyl-3,3-dimethylpiperidine);bis((2S)-1,4-ditert-butyl-2-methylpiperazine);bis((2R)-1,4-ditert-butyl-2-methylpiperazine);bis((2S)-1,4-ditert-butyl-2-methylpiperidine);bis((2R)-1,4-ditert-butyl-2-methylpiperidine);bis((3S)-1,4-ditert-butyl-3-methylpiperidine);bis((3R)-1,4-ditert-butyl-3-methylpiperidine)
PubChem CID158962024
Molecular FormulaC252H528N24
Molecular Weight3895.16 g/mol
Exact Mass3892.21
IUPAC Namebis(1,4-ditert-butyl-2,2-dimethylpiperazine);bis(1,4-ditert-butyl-2,2-dimethylpiperidine);bis(1,4-ditert-butyl-3,3-dimethylpiperidine);bis((2S)-1,4-ditert-butyl-2-methylpiperazine);bis((2R)-1,4-ditert-butyl-2-methylpiperazine);bis((2S)-1,4-ditert-butyl-2-methylpiperidine);bis((2R)-1,4-ditert-butyl-2-methylpiperidine);bis((3S)-1,4-ditert-butyl-3-methylpiperidine);bis((3R)-1,4-ditert-butyl-3-methylpiperidine)
SMILESCC(C)(C)C1CCN(C(C)(C)C)C(C)(C)C1.CC(C)(C)C1CCN(C(C)(C)C)C(C)(C)C1.CC(C)(C)C1CCN(C(C)(C)C)CC1(C)C.CC(C)(C)C1CCN(C(C)(C)C)CC1(C)C.CC(C)(C)N1CCN(C(C)(C)C)C(C)(C)C1.CC(C)(C)N1CCN(C(C)(C)C)C(C)(C)C1.C[C@@H]1CC(C(C)(C)C)CCN1C(C)(C)C.C[C@@H]1CC(C(C)(C)C)CCN1C(C)(C)C.C[C@@H]1CN(C(C)(C)C)CCC1C(C)(C)C.C[C@@H]1CN(C(C)(C)C)CCC1C(C)(C)C.C[C@@H]1CN(C(C)(C)C)CCN1C(C)(C)C.C[C@@H]1CN(C(C)(C)C)CCN1C(C)(C)C.C[C@H]1CC(C(C)(C)C)CCN1C(C)(C)C.C[C@H]1CC(C(C)(C)C)CCN1C(C)(C)C.C[C@H]1CN(C(C)(C)C)CCC1C(C)(C)C.C[C@H]1CN(C(C)(C)C)CCC1C(C)(C)C.C[C@H]1CN(C(C)(C)C)CCN1C(C)(C)C.C[C@H]1CN(C(C)(C)C)CCN1C(C)(C)C
InChIInChI=1S/4C15H31N.2C14H30N2.8C14H29N.4C13H28N2/c2*1-13(2,3)12-9-10-16(14(4,5)6)11-15(12,7)8;2*1-13(2,3)12-9-10-16(14(4,5)6)15(7,8)11-12;2*1-12(2,3)15-9-10-16(13(4,5)6)14(7,8)11-15;4*1-11-10-15(14(5,6)7)9-8-12(11)13(2,3)4;4*1-11-10-12(13(2,3)4)8-9-15(11)14(5,6)7;4*1-11-10-14(12(2,3)4)8-9-15(11)13(5,6)7/h4*12H,9-11H2,1-8H3;2*9-11H2,1-8H3;8*11-12H,8-10H2,1-7H3;4*11H,8-10H2,1-7H3/t;;;;;;8*11-,12?;4*11-/m......110011001100/s1
InChIKeyJMSWHUJCZFLFEL-LEKCXDFQSA-N
XLogP64.20
TPSA77.76 Ų
H-Bond Donors
H-Bond Acceptors24
Rotatable Bonds
Heavy Atoms276
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003895.16
LogP ≤ 564.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1024

Analyze bis(1,4-ditert-butyl-2,2-dimethylpiperazine);bis(1,4-ditert-butyl-2,2-dimethylpiperidine);bis(1,4-ditert-butyl-3,3-dimethylpiperidine);bis((2S)-1,4-ditert-butyl-2-methylpiperazine);bis((2R)-1,4-ditert-butyl-2-methylpiperazine);bis((2S)-1,4-ditert-butyl-2-methylpiperidine);bis((2R)-1,4-ditert-butyl-2-methylpiperidine);bis((3S)-1,4-ditert-butyl-3-methylpiperidine);bis((3R)-1,4-ditert-butyl-3-methylpiperidine) with MolForge

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Frequently Asked Questions

What is the IUPAC name of bis(1,4-ditert-butyl-2,2-dimethylpiperazine);bis(1,4-ditert-butyl-2,2-dimethylpiperidine);bis(1,4-ditert-butyl-3,3-dimethylpiperidine);bis((2S)-1,4-ditert-butyl-2-methylpiperazine);bis((2R)-1,4-ditert-butyl-2-methylpiperazine);bis((2S)-1,4-ditert-butyl-2-methylpiperidine);bis((2R)-1,4-ditert-butyl-2-methylpiperidine);bis((3S)-1,4-ditert-butyl-3-methylpiperidine);bis((3R)-1,4-ditert-butyl-3-methylpiperidine)?
The IUPAC name of bis(1,4-ditert-butyl-2,2-dimethylpiperazine);bis(1,4-ditert-butyl-2,2-dimethylpiperidine);bis(1,4-ditert-butyl-3,3-dimethylpiperidine);bis((2S)-1,4-ditert-butyl-2-methylpiperazine);bis((2R)-1,4-ditert-butyl-2-methylpiperazine);bis((2S)-1,4-ditert-butyl-2-methylpiperidine);bis((2R)-1,4-ditert-butyl-2-methylpiperidine);bis((3S)-1,4-ditert-butyl-3-methylpiperidine);bis((3R)-1,4-ditert-butyl-3-methylpiperidine) (CID 158962024) is bis(1,4-ditert-butyl-2,2-dimethylpiperazine);bis(1,4-ditert-butyl-2,2-dimethylpiperidine);bis(1,4-ditert-butyl-3,3-dimethylpiperidine);bis((2S)-1,4-ditert-butyl-2-methylpiperazine);bis((2R)-1,4-ditert-butyl-2-methylpiperazine);bis((2S)-1,4-ditert-butyl-2-methylpiperidine);bis((2R)-1,4-ditert-butyl-2-methylpiperidine);bis((3S)-1,4-ditert-butyl-3-methylpiperidine);bis((3R)-1,4-ditert-butyl-3-methylpiperidine).
What is the SMILES notation for bis(1,4-ditert-butyl-2,2-dimethylpiperazine);bis(1,4-ditert-butyl-2,2-dimethylpiperidine);bis(1,4-ditert-butyl-3,3-dimethylpiperidine);bis((2S)-1,4-ditert-butyl-2-methylpiperazine);bis((2R)-1,4-ditert-butyl-2-methylpiperazine);bis((2S)-1,4-ditert-butyl-2-methylpiperidine);bis((2R)-1,4-ditert-butyl-2-methylpiperidine);bis((3S)-1,4-ditert-butyl-3-methylpiperidine);bis((3R)-1,4-ditert-butyl-3-methylpiperidine)?
The canonical SMILES for bis(1,4-ditert-butyl-2,2-dimethylpiperazine);bis(1,4-ditert-butyl-2,2-dimethylpiperidine);bis(1,4-ditert-butyl-3,3-dimethylpiperidine);bis((2S)-1,4-ditert-butyl-2-methylpiperazine);bis((2R)-1,4-ditert-butyl-2-methylpiperazine);bis((2S)-1,4-ditert-butyl-2-methylpiperidine);bis((2R)-1,4-ditert-butyl-2-methylpiperidine);bis((3S)-1,4-ditert-butyl-3-methylpiperidine);bis((3R)-1,4-ditert-butyl-3-methylpiperidine) is CC(C)(C)C1CCN(C(C)(C)C)C(C)(C)C1.CC(C)(C)C1CCN(C(C)(C)C)C(C)(C)C1.CC(C)(C)C1CCN(C(C)(C)C)CC1(C)C.CC(C)(C)C1CCN(C(C)(C)C)CC1(C)C.CC(C)(C)N1CCN(C(C)(C)C)C(C)(C)C1.CC(C)(C)N1CCN(C(C)(C)C)C(C)(C)C1.C[C@@H]1CC(C(C)(C)C)CCN1C(C)(C)C.C[C@@H]1CC(C(C)(C)C)CCN1C(C)(C)C.C[C@@H]1CN(C(C)(C)C)CCC1C(C)(C)C.C[C@@H]1CN(C(C)(C)C)CCC1C(C)(C)C.C[C@@H]1CN(C(C)(C)C)CCN1C(C)(C)C.C[C@@H]1CN(C(C)(C)C)CCN1C(C)(C)C.C[C@H]1CC(C(C)(C)C)CCN1C(C)(C)C.C[C@H]1CC(C(C)(C)C)CCN1C(C)(C)C.C[C@H]1CN(C(C)(C)C)CCC1C(C)(C)C.C[C@H]1CN(C(C)(C)C)CCC1C(C)(C)C.C[C@H]1CN(C(C)(C)C)CCN1C(C)(C)C.C[C@H]1CN(C(C)(C)C)CCN1C(C)(C)C.
What is the InChIKey of bis(1,4-ditert-butyl-2,2-dimethylpiperazine);bis(1,4-ditert-butyl-2,2-dimethylpiperidine);bis(1,4-ditert-butyl-3,3-dimethylpiperidine);bis((2S)-1,4-ditert-butyl-2-methylpiperazine);bis((2R)-1,4-ditert-butyl-2-methylpiperazine);bis((2S)-1,4-ditert-butyl-2-methylpiperidine);bis((2R)-1,4-ditert-butyl-2-methylpiperidine);bis((3S)-1,4-ditert-butyl-3-methylpiperidine);bis((3R)-1,4-ditert-butyl-3-methylpiperidine)?
The InChIKey is JMSWHUJCZFLFEL-LEKCXDFQSA-N. The full InChI is InChI=1S/4C15H31N.2C14H30N2.8C14H29N.4C13H28N2/c2*1-13(2,3)12-9-10-16(14(4,5)6)11-15(12,7)8;2*1-13(2,3)12-9-10-16(14(4,5)6)15(7,8)11-12;2*1-12(2,3)15-9-10-16(13(4,5)6)14(7,8)11-15;4*1-11-10-15(14(5,6)7)9-8-12(11)13(2,3)4;4*1-11-10-12(13(2,3)4)8-9-15(11)14(5,6)7;4*1-11-10-14(12(2,3)4)8-9-15(11)13(5,6)7/h4*12H,9-11H2,1-8H3;2*9-11H2,1-8H3;8*11-12H,8-10H2,1-7H3;4*11H,8-10H2,1-7H3/t;;;;;;8*11-,12?;4*11-/m......110011001100/s1.
What are the key properties of bis(1,4-ditert-butyl-2,2-dimethylpiperazine);bis(1,4-ditert-butyl-2,2-dimethylpiperidine);bis(1,4-ditert-butyl-3,3-dimethylpiperidine);bis((2S)-1,4-ditert-butyl-2-methylpiperazine);bis((2R)-1,4-ditert-butyl-2-methylpiperazine);bis((2S)-1,4-ditert-butyl-2-methylpiperidine);bis((2R)-1,4-ditert-butyl-2-methylpiperidine);bis((3S)-1,4-ditert-butyl-3-methylpiperidine);bis((3R)-1,4-ditert-butyl-3-methylpiperidine)?
bis(1,4-ditert-butyl-2,2-dimethylpiperazine);bis(1,4-ditert-butyl-2,2-dimethylpiperidine);bis(1,4-ditert-butyl-3,3-dimethylpiperidine);bis((2S)-1,4-ditert-butyl-2-methylpiperazine);bis((2R)-1,4-ditert-butyl-2-methylpiperazine);bis((2S)-1,4-ditert-butyl-2-methylpiperidine);bis((2R)-1,4-ditert-butyl-2-methylpiperidine);bis((3S)-1,4-ditert-butyl-3-methylpiperidine);bis((3R)-1,4-ditert-butyl-3-methylpiperidine) has a molecular weight of 3895.16 g/mol, XLogP of 64.20, 0 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for bis(1,4-ditert-butyl-2,2-dimethylpiperazine);bis(1,4-ditert-butyl-2,2-dimethylpiperidine);bis(1,4-ditert-butyl-3,3-dimethylpiperidine);bis((2S)-1,4-ditert-butyl-2-methylpiperazine);bis((2R)-1,4-ditert-butyl-2-methylpiperazine);bis((2S)-1,4-ditert-butyl-2-methylpiperidine);bis((2R)-1,4-ditert-butyl-2-methylpiperidine);bis((3S)-1,4-ditert-butyl-3-methylpiperidine);bis((3R)-1,4-ditert-butyl-3-methylpiperidine) is sourced from PubChem (CID 158962024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).