5-butan-2-yl-1-(cyclobutylmethyl)-2-ethyl-2-methylpiperazine

C16H32N2 — CID 65462478

IUPAC5-butan-2-yl-1-(cyclobutylmethyl)-2-ethyl-2-methylpiperazine
SMILESCCC(C)C1CN(CC2CCC2)C(C)(CC)CN1
InChIInChI=1S/C16H32N2/c1-5-13(3)15-11-18(10-14-8-7-9-14)16(4,6-2)12-17-15/h13-15,17H,5-12H2,1-4H3
InChIKeyZRCYHBHSWPPFKN-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.28
Rot. Bonds5

About 5-butan-2-yl-1-(cyclobutylmethyl)-2-ethyl-2-methylpiperazine

5-butan-2-yl-1-(cyclobutylmethyl)-2-ethyl-2-methylpiperazine (PubChem CID 65462478) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 5-butan-2-yl-1-(cyclobutylmethyl)-2-ethyl-2-methylpiperazine.

Molecular Properties

Compound Name5-butan-2-yl-1-(cyclobutylmethyl)-2-ethyl-2-methylpiperazine
PubChem CID65462478
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name5-butan-2-yl-1-(cyclobutylmethyl)-2-ethyl-2-methylpiperazine
SMILESCCC(C)C1CN(CC2CCC2)C(C)(CC)CN1
InChIInChI=1S/C16H32N2/c1-5-13(3)15-11-18(10-14-8-7-9-14)16(4,6-2)12-17-15/h13-15,17H,5-12H2,1-4H3
InChIKeyZRCYHBHSWPPFKN-UHFFFAOYSA-N
XLogP3.28
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-butan-2-yl-1-(cyclopropylmethyl)-2-ethyl-2-methylpiperazine
CID 64849416
8-butan-2-yl-6-(cyclobutylmethyl)-6,9-diazaspiro[4.5]decane
CID 65462680
5-butan-2-yl-2-ethyl-2-methyl-1-propylpiperazine
CID 64847681
5-butan-2-yl-2-ethyl-2-methyl-1-(2-methylbutyl)piperazine
CID 64848260
5-tert-butyl-1-(cyclobutylmethyl)-2-ethyl-2-methylpiperazine
CID 65460670
5-butan-2-yl-1-(3-chloro-2-methylprop-2-enyl)-2-ethyl-2-methylpiperazine
CID 106440446
5-butan-2-yl-2-ethyl-2-methyl-1-(2-pyrazol-1-ylethyl)piperazine
CID 64847296
5-butan-2-yl-2-ethyl-2-methyl-1-(2-thiophen-3-ylethyl)piperazine
CID 64847295
5-butan-2-yl-2-cyclopropyl-1-ethyl-2-methylpiperazine
CID 64849041
5-butan-2-yl-2,2-diethyl-1-(2-methylbutyl)piperazine
CID 64848840
5-butan-2-yl-2-ethyl-2-methyl-1-(pyridin-3-ylmethyl)piperazine
CID 64849613
1-(cyclopentylmethyl)-2-ethyl-2-methyl-5-phenylpiperazine
CID 64876896

Frequently Asked Questions

What is the IUPAC name of 5-butan-2-yl-1-(cyclobutylmethyl)-2-ethyl-2-methylpiperazine?
The IUPAC name of 5-butan-2-yl-1-(cyclobutylmethyl)-2-ethyl-2-methylpiperazine (CID 65462478) is 5-butan-2-yl-1-(cyclobutylmethyl)-2-ethyl-2-methylpiperazine.
What is the SMILES notation for 5-butan-2-yl-1-(cyclobutylmethyl)-2-ethyl-2-methylpiperazine?
The canonical SMILES for 5-butan-2-yl-1-(cyclobutylmethyl)-2-ethyl-2-methylpiperazine is CCC(C)C1CN(CC2CCC2)C(C)(CC)CN1.
What is the InChIKey of 5-butan-2-yl-1-(cyclobutylmethyl)-2-ethyl-2-methylpiperazine?
The InChIKey is ZRCYHBHSWPPFKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-5-13(3)15-11-18(10-14-8-7-9-14)16(4,6-2)12-17-15/h13-15,17H,5-12H2,1-4H3.
What are the key properties of 5-butan-2-yl-1-(cyclobutylmethyl)-2-ethyl-2-methylpiperazine?
5-butan-2-yl-1-(cyclobutylmethyl)-2-ethyl-2-methylpiperazine has a molecular weight of 252.45 g/mol, XLogP of 3.28, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butan-2-yl-1-(cyclobutylmethyl)-2-ethyl-2-methylpiperazine is sourced from PubChem (CID 65462478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).