1-(3,3-dimethylbutan-2-yl)-2,5-di(propan-2-yl)piperazine

C16H34N2 — CID 104830217

IUPAC1-(3,3-dimethylbutan-2-yl)-2,5-di(propan-2-yl)piperazine
SMILESCC(C)C1CN(C(C)C(C)(C)C)C(C(C)C)CN1
InChIInChI=1S/C16H34N2/c1-11(2)14-10-18(13(5)16(6,7)8)15(9-17-14)12(3)4/h11-15,17H,9-10H2,1-8H3
InChIKeyGZBQVWCCENOHQD-UHFFFAOYSA-N
MW254.46 g/mol
LogP3.38
Rot. Bonds3

About 1-(3,3-dimethylbutan-2-yl)-2,5-di(propan-2-yl)piperazine

1-(3,3-dimethylbutan-2-yl)-2,5-di(propan-2-yl)piperazine (PubChem CID 104830217) has the molecular formula C16H34N2 and a molecular weight of 254.46 g/mol. Its IUPAC name is 1-(3,3-dimethylbutan-2-yl)-2,5-di(propan-2-yl)piperazine.

Molecular Properties

Compound Name1-(3,3-dimethylbutan-2-yl)-2,5-di(propan-2-yl)piperazine
PubChem CID104830217
Molecular FormulaC16H34N2
Molecular Weight254.46 g/mol
Exact Mass254.27
IUPAC Name1-(3,3-dimethylbutan-2-yl)-2,5-di(propan-2-yl)piperazine
SMILESCC(C)C1CN(C(C)C(C)(C)C)C(C(C)C)CN1
InChIInChI=1S/C16H34N2/c1-11(2)14-10-18(13(5)16(6,7)8)15(9-17-14)12(3)4/h11-15,17H,9-10H2,1-8H3
InChIKeyGZBQVWCCENOHQD-UHFFFAOYSA-N
XLogP3.38
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.46
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-cyclopentylethyl)-2,5-di(propan-2-yl)piperazine
CID 64936479
1-cyclopropyl-2,5-di(propan-2-yl)piperazine
CID 64954463
1-(3-ethylpentan-3-yl)-2,5-di(propan-2-yl)piperazine
CID 65043346
1-[1-(2,5-dimethylfuran-3-yl)ethyl]-2,5-di(propan-2-yl)piperazine
CID 64936619
1-cycloheptyl-2,5-di(propan-2-yl)piperazine
CID 64936529
1-(2,2-dimethylcyclopropyl)-2,5-di(propan-2-yl)piperazine
CID 64939305
5-butan-2-yl-1-(1-cyclopropylethyl)-2-propan-2-ylpiperazine
CID 64939021
2,5-di(propan-2-yl)-1-prop-2-ynylpiperazine
CID 64937920
5-butan-2-yl-1-pent-1-yn-3-yl-2-propan-2-ylpiperazine
CID 106224498
2-cyclopropyl-1-pentan-2-yl-5-propan-2-ylpiperazine
CID 114013050
1-(2-piperidin-1-ylethyl)-2,5-di(propan-2-yl)piperazine
CID 82249272
1-(3,4-dimethylcyclohexyl)-2,5-di(propan-2-yl)piperazine
CID 64936701

Frequently Asked Questions

What is the IUPAC name of 1-(3,3-dimethylbutan-2-yl)-2,5-di(propan-2-yl)piperazine?
The IUPAC name of 1-(3,3-dimethylbutan-2-yl)-2,5-di(propan-2-yl)piperazine (CID 104830217) is 1-(3,3-dimethylbutan-2-yl)-2,5-di(propan-2-yl)piperazine.
What is the SMILES notation for 1-(3,3-dimethylbutan-2-yl)-2,5-di(propan-2-yl)piperazine?
The canonical SMILES for 1-(3,3-dimethylbutan-2-yl)-2,5-di(propan-2-yl)piperazine is CC(C)C1CN(C(C)C(C)(C)C)C(C(C)C)CN1.
What is the InChIKey of 1-(3,3-dimethylbutan-2-yl)-2,5-di(propan-2-yl)piperazine?
The InChIKey is GZBQVWCCENOHQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2/c1-11(2)14-10-18(13(5)16(6,7)8)15(9-17-14)12(3)4/h11-15,17H,9-10H2,1-8H3.
What are the key properties of 1-(3,3-dimethylbutan-2-yl)-2,5-di(propan-2-yl)piperazine?
1-(3,3-dimethylbutan-2-yl)-2,5-di(propan-2-yl)piperazine has a molecular weight of 254.46 g/mol, XLogP of 3.38, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,3-dimethylbutan-2-yl)-2,5-di(propan-2-yl)piperazine is sourced from PubChem (CID 104830217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).