1-(2-butoxyethyl)-5,5-dimethyl-2-propylpiperazine

C15H32N2O — CID 64840075

IUPAC1-(2-butoxyethyl)-5,5-dimethyl-2-propylpiperazine
SMILESCCCCOCCN1CC(C)(C)NCC1CCC
InChIInChI=1S/C15H32N2O/c1-5-7-10-18-11-9-17-13-15(3,4)16-12-14(17)8-6-2/h14,16H,5-13H2,1-4H3
InChIKeyBAXLFAKPCPUPLR-UHFFFAOYSA-N
MW256.43 g/mol
LogP2.66
Rot. Bonds8

About 1-(2-butoxyethyl)-5,5-dimethyl-2-propylpiperazine

1-(2-butoxyethyl)-5,5-dimethyl-2-propylpiperazine (PubChem CID 64840075) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is 1-(2-butoxyethyl)-5,5-dimethyl-2-propylpiperazine.

Molecular Properties

Compound Name1-(2-butoxyethyl)-5,5-dimethyl-2-propylpiperazine
PubChem CID64840075
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC Name1-(2-butoxyethyl)-5,5-dimethyl-2-propylpiperazine
SMILESCCCCOCCN1CC(C)(C)NCC1CCC
InChIInChI=1S/C15H32N2O/c1-5-7-10-18-11-9-17-13-15(3,4)16-12-14(17)8-6-2/h14,16H,5-13H2,1-4H3
InChIKeyBAXLFAKPCPUPLR-UHFFFAOYSA-N
XLogP2.66
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
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

1-(2-butoxyethyl)-2,5,5-trimethylpiperazine
CID 64840639
1-(2-butoxyethyl)-5,5-dimethyl-2-phenylpiperazine
CID 64839744
5,5-dimethyl-2-propyl-1-[2-(trifluoromethylsulfanyl)ethyl]piperazine
CID 116627433
1-butyl-5,5-dimethyl-2-(2-methylpropyl)piperazine
CID 64838733
1-[2-(3-bromophenoxy)ethyl]-5,5-dimethyl-2-propylpiperazine
CID 64837750
5,5-dimethyl-2-propyl-1-(2-pyrazol-1-ylethyl)piperazine
CID 64837941
3,3,7-trimethyl-1-(2-propoxyethyl)-1,4-diazepane
CID 106458876
(5,5-dimethyl-1-propylpiperazin-2-yl)methanol
CID 82241015
1-(3-ethoxypropyl)-2,5,5-trimethylpiperazine
CID 64931860
5-ethyl-1-[2-(3-methoxypropoxy)ethyl]-5-methyl-2-(2-methylpropyl)piperazine
CID 103184549
1-(2-butoxyethyl)-3,3-dimethyl-1,4-diazepane
CID 64870671
1-[2-(4-bromophenoxy)ethyl]-2-ethyl-5,5-dimethylpiperazine
CID 64840072

Frequently Asked Questions

What is the IUPAC name of 1-(2-butoxyethyl)-5,5-dimethyl-2-propylpiperazine?
The IUPAC name of 1-(2-butoxyethyl)-5,5-dimethyl-2-propylpiperazine (CID 64840075) is 1-(2-butoxyethyl)-5,5-dimethyl-2-propylpiperazine.
What is the SMILES notation for 1-(2-butoxyethyl)-5,5-dimethyl-2-propylpiperazine?
The canonical SMILES for 1-(2-butoxyethyl)-5,5-dimethyl-2-propylpiperazine is CCCCOCCN1CC(C)(C)NCC1CCC.
What is the InChIKey of 1-(2-butoxyethyl)-5,5-dimethyl-2-propylpiperazine?
The InChIKey is BAXLFAKPCPUPLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-5-7-10-18-11-9-17-13-15(3,4)16-12-14(17)8-6-2/h14,16H,5-13H2,1-4H3.
What are the key properties of 1-(2-butoxyethyl)-5,5-dimethyl-2-propylpiperazine?
1-(2-butoxyethyl)-5,5-dimethyl-2-propylpiperazine has a molecular weight of 256.43 g/mol, XLogP of 2.66, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-butoxyethyl)-5,5-dimethyl-2-propylpiperazine is sourced from PubChem (CID 64840075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).