5-butan-2-yl-2,2-dimethyl-1-(2-propan-2-yloxyethyl)piperazine

C15H32N2O — CID 64849215

IUPAC5-butan-2-yl-2,2-dimethyl-1-(2-propan-2-yloxyethyl)piperazine
SMILESCCC(C)C1CN(CCOC(C)C)C(C)(C)CN1
InChIInChI=1S/C15H32N2O/c1-7-13(4)14-10-17(8-9-18-12(2)3)15(5,6)11-16-14/h12-14,16H,7-11H2,1-6H3
InChIKeyQZRYKKHLTGYNRH-UHFFFAOYSA-N
MW256.43 g/mol
LogP2.51
Rot. Bonds6

About 5-butan-2-yl-2,2-dimethyl-1-(2-propan-2-yloxyethyl)piperazine

5-butan-2-yl-2,2-dimethyl-1-(2-propan-2-yloxyethyl)piperazine (PubChem CID 64849215) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is 5-butan-2-yl-2,2-dimethyl-1-(2-propan-2-yloxyethyl)piperazine.

Molecular Properties

Compound Name5-butan-2-yl-2,2-dimethyl-1-(2-propan-2-yloxyethyl)piperazine
PubChem CID64849215
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC Name5-butan-2-yl-2,2-dimethyl-1-(2-propan-2-yloxyethyl)piperazine
SMILESCCC(C)C1CN(CCOC(C)C)C(C)(C)CN1
InChIInChI=1S/C15H32N2O/c1-7-13(4)14-10-17(8-9-18-12(2)3)15(5,6)11-16-14/h12-14,16H,7-11H2,1-6H3
InChIKeyQZRYKKHLTGYNRH-UHFFFAOYSA-N
XLogP2.51
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-butan-2-yl-1-(2-ethoxyethyl)-2,2-dimethylpiperazine
CID 64848829
8-butan-2-yl-6-(2-propan-2-yloxyethyl)-6,9-diazaspiro[4.5]decane
CID 64850001
5-butan-2-yl-1-(2-fluoroethyl)-2,2-dimethylpiperazine
CID 80696297
5-butan-2-yl-1-(2-ethylsulfonylethyl)-2,2-dimethylpiperazine
CID 106733099
5-butan-2-yl-1,2,2-trimethylpiperazine
CID 64847098
5-butan-2-yl-1-(3-ethylsulfonylpropyl)-2,2-dimethylpiperazine
CID 65097377
5-butan-2-yl-1-(2,2-difluoroethyl)-2,2-dimethylpiperazine
CID 64849409
5-cyclohexyl-2,2-dimethyl-1-(2-propan-2-yloxyethyl)piperazine
CID 64861713
5-butan-2-yl-2,2-dimethyl-1-(3-phenylpropyl)piperazine
CID 64849218
5-butan-2-yl-2-cyclopropyl-1-(2-methoxyethyl)-2-methylpiperazine
CID 64848079
5-butan-2-yl-2,2-dimethyl-1-(pyridin-4-ylmethyl)piperazine
CID 64848063
5-butan-2-yl-2,2-dimethyl-1-(2-thiophen-3-ylethyl)piperazine
CID 64848061

Frequently Asked Questions

What is the IUPAC name of 5-butan-2-yl-2,2-dimethyl-1-(2-propan-2-yloxyethyl)piperazine?
The IUPAC name of 5-butan-2-yl-2,2-dimethyl-1-(2-propan-2-yloxyethyl)piperazine (CID 64849215) is 5-butan-2-yl-2,2-dimethyl-1-(2-propan-2-yloxyethyl)piperazine.
What is the SMILES notation for 5-butan-2-yl-2,2-dimethyl-1-(2-propan-2-yloxyethyl)piperazine?
The canonical SMILES for 5-butan-2-yl-2,2-dimethyl-1-(2-propan-2-yloxyethyl)piperazine is CCC(C)C1CN(CCOC(C)C)C(C)(C)CN1.
What is the InChIKey of 5-butan-2-yl-2,2-dimethyl-1-(2-propan-2-yloxyethyl)piperazine?
The InChIKey is QZRYKKHLTGYNRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-7-13(4)14-10-17(8-9-18-12(2)3)15(5,6)11-16-14/h12-14,16H,7-11H2,1-6H3.
What are the key properties of 5-butan-2-yl-2,2-dimethyl-1-(2-propan-2-yloxyethyl)piperazine?
5-butan-2-yl-2,2-dimethyl-1-(2-propan-2-yloxyethyl)piperazine has a molecular weight of 256.43 g/mol, XLogP of 2.51, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butan-2-yl-2,2-dimethyl-1-(2-propan-2-yloxyethyl)piperazine is sourced from PubChem (CID 64849215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).