5-butan-2-yl-2,2-diethyl-1-(2-methylbutyl)piperazine

C17H36N2 — CID 64848840

IUPAC5-butan-2-yl-2,2-diethyl-1-(2-methylbutyl)piperazine
SMILESCCC(C)CN1CC(C(C)CC)NCC1(CC)CC
InChIInChI=1S/C17H36N2/c1-7-14(5)11-19-12-16(15(6)8-2)18-13-17(19,9-3)10-4/h14-16,18H,7-13H2,1-6H3
InChIKeyAWTVIDXPILVZSN-UHFFFAOYSA-N
MW268.49 g/mol
LogP3.91
Rot. Bonds7

About 5-butan-2-yl-2,2-diethyl-1-(2-methylbutyl)piperazine

5-butan-2-yl-2,2-diethyl-1-(2-methylbutyl)piperazine (PubChem CID 64848840) has the molecular formula C17H36N2 and a molecular weight of 268.49 g/mol. Its IUPAC name is 5-butan-2-yl-2,2-diethyl-1-(2-methylbutyl)piperazine.

Molecular Properties

Compound Name5-butan-2-yl-2,2-diethyl-1-(2-methylbutyl)piperazine
PubChem CID64848840
Molecular FormulaC17H36N2
Molecular Weight268.49 g/mol
Exact Mass268.29
IUPAC Name5-butan-2-yl-2,2-diethyl-1-(2-methylbutyl)piperazine
SMILESCCC(C)CN1CC(C(C)CC)NCC1(CC)CC
InChIInChI=1S/C17H36N2/c1-7-14(5)11-19-12-16(15(6)8-2)18-13-17(19,9-3)10-4/h14-16,18H,7-13H2,1-6H3
InChIKeyAWTVIDXPILVZSN-UHFFFAOYSA-N
XLogP3.91
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.49
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-butan-2-yl-2-ethyl-2-methyl-1-(2-methylbutyl)piperazine
CID 64848260
1,5-di(butan-2-yl)-2,2-diethylpiperazine
CID 79445458
1-(2,2-difluoroethyl)-2,2-diethyl-5-propan-2-ylpiperazine
CID 64839847
2,2-dimethyl-1-(2-methylbutyl)-5-propan-2-ylpiperazine
CID 64840227
5-butan-2-yl-2,2-diethyl-1-(pyridin-3-ylmethyl)piperazine
CID 64849616
5-butan-2-yl-1-(cyclopropylmethyl)-2-ethyl-2-methylpiperazine
CID 64849416
5-butan-2-yl-1-(2,2-difluoroethyl)-2,2-dimethylpiperazine
CID 64849409
5-butan-2-yl-2-ethyl-2-methyl-1-propylpiperazine
CID 64847681
5-butan-2-yl-1-(cyclobutylmethyl)-2-ethyl-2-methylpiperazine
CID 65462478
5-butan-2-yl-2-cyclopropyl-1-ethyl-2-methylpiperazine
CID 64849041
5-butan-2-yl-1,2,2-trimethylpiperazine
CID 64847098
5-butan-2-yl-2,2-diethyl-1-(oxolan-3-yl)piperazine
CID 64848456

Frequently Asked Questions

What is the IUPAC name of 5-butan-2-yl-2,2-diethyl-1-(2-methylbutyl)piperazine?
The IUPAC name of 5-butan-2-yl-2,2-diethyl-1-(2-methylbutyl)piperazine (CID 64848840) is 5-butan-2-yl-2,2-diethyl-1-(2-methylbutyl)piperazine.
What is the SMILES notation for 5-butan-2-yl-2,2-diethyl-1-(2-methylbutyl)piperazine?
The canonical SMILES for 5-butan-2-yl-2,2-diethyl-1-(2-methylbutyl)piperazine is CCC(C)CN1CC(C(C)CC)NCC1(CC)CC.
What is the InChIKey of 5-butan-2-yl-2,2-diethyl-1-(2-methylbutyl)piperazine?
The InChIKey is AWTVIDXPILVZSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36N2/c1-7-14(5)11-19-12-16(15(6)8-2)18-13-17(19,9-3)10-4/h14-16,18H,7-13H2,1-6H3.
What are the key properties of 5-butan-2-yl-2,2-diethyl-1-(2-methylbutyl)piperazine?
5-butan-2-yl-2,2-diethyl-1-(2-methylbutyl)piperazine has a molecular weight of 268.49 g/mol, XLogP of 3.91, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butan-2-yl-2,2-diethyl-1-(2-methylbutyl)piperazine is sourced from PubChem (CID 64848840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).