2,2-diethyl-5,5-dimethyl-1-[3-(oxolan-2-yl)propyl]piperazine

C17H34N2O — CID 65170575

IUPAC2,2-diethyl-5,5-dimethyl-1-[3-(oxolan-2-yl)propyl]piperazine
SMILESCCC1(CC)CNC(C)(C)CN1CCCC1CCCO1
InChIInChI=1S/C17H34N2O/c1-5-17(6-2)13-18-16(3,4)14-19(17)11-7-9-15-10-8-12-20-15/h15,18H,5-14H2,1-4H3
InChIKeyCFDHQDMDYLPEMJ-UHFFFAOYSA-N
MW282.47 g/mol
LogP3.19
Rot. Bonds6

About 2,2-diethyl-5,5-dimethyl-1-[3-(oxolan-2-yl)propyl]piperazine

2,2-diethyl-5,5-dimethyl-1-[3-(oxolan-2-yl)propyl]piperazine (PubChem CID 65170575) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is 2,2-diethyl-5,5-dimethyl-1-[3-(oxolan-2-yl)propyl]piperazine.

Molecular Properties

Compound Name2,2-diethyl-5,5-dimethyl-1-[3-(oxolan-2-yl)propyl]piperazine
PubChem CID65170575
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC Name2,2-diethyl-5,5-dimethyl-1-[3-(oxolan-2-yl)propyl]piperazine
SMILESCCC1(CC)CNC(C)(C)CN1CCCC1CCCO1
InChIInChI=1S/C17H34N2O/c1-5-17(6-2)13-18-16(3,4)14-19(17)11-7-9-15-10-8-12-20-15/h15,18H,5-14H2,1-4H3
InChIKeyCFDHQDMDYLPEMJ-UHFFFAOYSA-N
XLogP3.19
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,2,5-triethyl-1-[3-(oxolan-2-yl)propyl]piperazine
CID 65170182
5,5-diethyl-2,2-dimethyl-1-[3-(oxolan-2-yl)propyl]piperazine
CID 65170045
8,8-diethyl-9-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane
CID 64877784
2-cyclopropyl-2-methyl-1-[3-(oxolan-2-yl)propyl]piperazine
CID 65170422
5-cyclopropyl-2,2-diethyl-1-[2-(oxolan-2-yl)ethyl]piperazine
CID 65170489
5-ethyl-5-methyl-1-[3-(oxolan-2-yl)propyl]-2-propan-2-ylpiperazine
CID 65170433
3,3-dimethyl-1-[2-(oxolan-2-yl)ethyl]-1,4-diazepane
CID 64943274
2,5,5-trimethyl-1-[2-(oxolan-2-yl)ethyl]piperazine
CID 64947488
2,2-diethyl-1-(2-ethylsulfonylethyl)-5,5-dimethylpiperazine
CID 106732956
5,5-dimethyl-2-(2-methylpropyl)-1-[2-(oxolan-2-yl)ethyl]piperazine
CID 65170378
5-cyclopropyl-5-methyl-1-[3-(oxolan-2-yl)propyl]-2-propan-2-ylpiperazine
CID 65170486
8-cyclopropyl-8-methyl-6-[2-(oxolan-2-yl)ethyl]-6,9-diazaspiro[4.5]decane
CID 65170634

Frequently Asked Questions

What is the IUPAC name of 2,2-diethyl-5,5-dimethyl-1-[3-(oxolan-2-yl)propyl]piperazine?
The IUPAC name of 2,2-diethyl-5,5-dimethyl-1-[3-(oxolan-2-yl)propyl]piperazine (CID 65170575) is 2,2-diethyl-5,5-dimethyl-1-[3-(oxolan-2-yl)propyl]piperazine.
What is the SMILES notation for 2,2-diethyl-5,5-dimethyl-1-[3-(oxolan-2-yl)propyl]piperazine?
The canonical SMILES for 2,2-diethyl-5,5-dimethyl-1-[3-(oxolan-2-yl)propyl]piperazine is CCC1(CC)CNC(C)(C)CN1CCCC1CCCO1.
What is the InChIKey of 2,2-diethyl-5,5-dimethyl-1-[3-(oxolan-2-yl)propyl]piperazine?
The InChIKey is CFDHQDMDYLPEMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-5-17(6-2)13-18-16(3,4)14-19(17)11-7-9-15-10-8-12-20-15/h15,18H,5-14H2,1-4H3.
What are the key properties of 2,2-diethyl-5,5-dimethyl-1-[3-(oxolan-2-yl)propyl]piperazine?
2,2-diethyl-5,5-dimethyl-1-[3-(oxolan-2-yl)propyl]piperazine has a molecular weight of 282.47 g/mol, XLogP of 3.19, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diethyl-5,5-dimethyl-1-[3-(oxolan-2-yl)propyl]piperazine is sourced from PubChem (CID 65170575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).