5,5-diethyl-2,2-dimethyl-1-(2-propoxyethyl)piperazine

C15H32N2O — CID 106458801

IUPAC5,5-diethyl-2,2-dimethyl-1-(2-propoxyethyl)piperazine
SMILESCCCOCCN1CC(CC)(CC)NCC1(C)C
InChIInChI=1S/C15H32N2O/c1-6-10-18-11-9-17-13-15(7-2,8-3)16-12-14(17,4)5/h16H,6-13H2,1-5H3
InChIKeyCKOVXROLDNIADO-UHFFFAOYSA-N
MW256.43 g/mol
LogP2.66
Rot. Bonds7

About 5,5-diethyl-2,2-dimethyl-1-(2-propoxyethyl)piperazine

5,5-diethyl-2,2-dimethyl-1-(2-propoxyethyl)piperazine (PubChem CID 106458801) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is 5,5-diethyl-2,2-dimethyl-1-(2-propoxyethyl)piperazine.

Molecular Properties

Compound Name5,5-diethyl-2,2-dimethyl-1-(2-propoxyethyl)piperazine
PubChem CID106458801
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC Name5,5-diethyl-2,2-dimethyl-1-(2-propoxyethyl)piperazine
SMILESCCCOCCN1CC(CC)(CC)NCC1(C)C
InChIInChI=1S/C15H32N2O/c1-6-10-18-11-9-17-13-15(7-2,8-3)16-12-14(17,4)5/h16H,6-13H2,1-5H3
InChIKeyCKOVXROLDNIADO-UHFFFAOYSA-N
XLogP2.66
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5,5-diethyl-2,2-dimethyl-1-[2-(3-methylbutoxy)ethyl]piperazine
CID 64862566
2,2,5,5-tetraethyl-1-(2-propoxyethyl)piperazine
CID 106458805
6-(2-butoxyethyl)-8,8-diethyl-6,9-diazaspiro[4.5]decane
CID 64861043
5,5-diethyl-1-(2-ethylbutyl)-2,2-dimethylpiperazine
CID 82925143
5,5-diethyl-2,2-dimethyl-1-(2-propan-2-ylsulfonylethyl)piperazine
CID 106733253
8-ethyl-8-methyl-9-(2-propoxyethyl)-6,9-diazaspiro[4.5]decane
CID 106458732
2-cyclopropyl-5,5-diethyl-2-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine
CID 115943677
4-(2-ethoxyethyl)-3,3-dimethyl-1,4-diazaspiro[5.5]undecane
CID 64878399
3,3-dimethyl-1-(2-propoxyethyl)-1,4-diazaspiro[5.5]undecane
CID 106458595
5,5-diethyl-2,2-dimethyl-1-[(1-methylpyrazol-4-yl)methyl]piperazine
CID 64861803
5,5-diethyl-1-[(4-ethylphenyl)methyl]-2,2-dimethylpiperazine
CID 64861798
5,5-diethyl-2,2-dimethyl-1-[3-(oxolan-2-yl)propyl]piperazine
CID 65170045

Frequently Asked Questions

What is the IUPAC name of 5,5-diethyl-2,2-dimethyl-1-(2-propoxyethyl)piperazine?
The IUPAC name of 5,5-diethyl-2,2-dimethyl-1-(2-propoxyethyl)piperazine (CID 106458801) is 5,5-diethyl-2,2-dimethyl-1-(2-propoxyethyl)piperazine.
What is the SMILES notation for 5,5-diethyl-2,2-dimethyl-1-(2-propoxyethyl)piperazine?
The canonical SMILES for 5,5-diethyl-2,2-dimethyl-1-(2-propoxyethyl)piperazine is CCCOCCN1CC(CC)(CC)NCC1(C)C.
What is the InChIKey of 5,5-diethyl-2,2-dimethyl-1-(2-propoxyethyl)piperazine?
The InChIKey is CKOVXROLDNIADO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-6-10-18-11-9-17-13-15(7-2,8-3)16-12-14(17,4)5/h16H,6-13H2,1-5H3.
What are the key properties of 5,5-diethyl-2,2-dimethyl-1-(2-propoxyethyl)piperazine?
5,5-diethyl-2,2-dimethyl-1-(2-propoxyethyl)piperazine has a molecular weight of 256.43 g/mol, XLogP of 2.66, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-diethyl-2,2-dimethyl-1-(2-propoxyethyl)piperazine is sourced from PubChem (CID 106458801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).