2-cyclopropyl-2-methyl-5-(2-methylpropyl)-1-(2-propoxyethyl)piperazine

C17H34N2O — CID 106458668

IUPAC2-cyclopropyl-2-methyl-5-(2-methylpropyl)-1-(2-propoxyethyl)piperazine
SMILESCCCOCCN1CC(CC(C)C)NCC1(C)C1CC1
InChIInChI=1S/C17H34N2O/c1-5-9-20-10-8-19-12-16(11-14(2)3)18-13-17(19,4)15-6-7-15/h14-16,18H,5-13H2,1-4H3
InChIKeyASBXAPKQYJHCMY-UHFFFAOYSA-N
MW282.47 g/mol
LogP2.90
Rot. Bonds8

About 2-cyclopropyl-2-methyl-5-(2-methylpropyl)-1-(2-propoxyethyl)piperazine

2-cyclopropyl-2-methyl-5-(2-methylpropyl)-1-(2-propoxyethyl)piperazine (PubChem CID 106458668) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is 2-cyclopropyl-2-methyl-5-(2-methylpropyl)-1-(2-propoxyethyl)piperazine.

Molecular Properties

Compound Name2-cyclopropyl-2-methyl-5-(2-methylpropyl)-1-(2-propoxyethyl)piperazine
PubChem CID106458668
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC Name2-cyclopropyl-2-methyl-5-(2-methylpropyl)-1-(2-propoxyethyl)piperazine
SMILESCCCOCCN1CC(CC(C)C)NCC1(C)C1CC1
InChIInChI=1S/C17H34N2O/c1-5-9-20-10-8-19-12-16(11-14(2)3)18-13-17(19,4)15-6-7-15/h14-16,18H,5-13H2,1-4H3
InChIKeyASBXAPKQYJHCMY-UHFFFAOYSA-N
XLogP2.90
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 52.90
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

2-cyclopropyl-2,5-dimethyl-1-(2-propoxyethyl)piperazine
CID 106458523
2-cyclopropyl-1-hexyl-2-methyl-5-(2-methylpropyl)piperazine
CID 64849739
2-cyclopropyl-2-methyl-1-[2-(2-methylpropoxy)ethyl]-5-propylpiperazine
CID 106458552
2-ethyl-1-[2-(3-methoxypropoxy)ethyl]-2-methyl-5-(2-methylpropyl)piperazine
CID 103184536
2-cyclopropyl-5-ethyl-2-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine
CID 112592075
2-cyclopropyl-1-(3-methoxypropyl)-2-methyl-5-propylpiperazine
CID 64839994
1-butyl-2-cyclopropyl-2-methyl-5-propylpiperazine
CID 64839603
5-butan-2-yl-2-cyclopropyl-1-(2-methoxyethyl)-2-methylpiperazine
CID 64848079
2,2-dimethyl-1-[2-(3-methylbutoxy)ethyl]-5-propylpiperazine
CID 64839580
2,5-dicyclopropyl-2-methyl-1-(2-propan-2-yloxyethyl)piperazine
CID 64862471
1-butyl-2-cyclopropyl-2-methyl-5-propan-2-ylpiperazine
CID 64838885
1-[(5-chlorothiophen-2-yl)methyl]-2-cyclopropyl-2-methyl-5-(2-methylpropyl)piperazine
CID 64847233

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-methyl-5-(2-methylpropyl)-1-(2-propoxyethyl)piperazine?
The IUPAC name of 2-cyclopropyl-2-methyl-5-(2-methylpropyl)-1-(2-propoxyethyl)piperazine (CID 106458668) is 2-cyclopropyl-2-methyl-5-(2-methylpropyl)-1-(2-propoxyethyl)piperazine.
What is the SMILES notation for 2-cyclopropyl-2-methyl-5-(2-methylpropyl)-1-(2-propoxyethyl)piperazine?
The canonical SMILES for 2-cyclopropyl-2-methyl-5-(2-methylpropyl)-1-(2-propoxyethyl)piperazine is CCCOCCN1CC(CC(C)C)NCC1(C)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-methyl-5-(2-methylpropyl)-1-(2-propoxyethyl)piperazine?
The InChIKey is ASBXAPKQYJHCMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-5-9-20-10-8-19-12-16(11-14(2)3)18-13-17(19,4)15-6-7-15/h14-16,18H,5-13H2,1-4H3.
What are the key properties of 2-cyclopropyl-2-methyl-5-(2-methylpropyl)-1-(2-propoxyethyl)piperazine?
2-cyclopropyl-2-methyl-5-(2-methylpropyl)-1-(2-propoxyethyl)piperazine has a molecular weight of 282.47 g/mol, XLogP of 2.90, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-methyl-5-(2-methylpropyl)-1-(2-propoxyethyl)piperazine is sourced from PubChem (CID 106458668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).