2-methyl-5-propan-2-yl-1-(4-propan-2-yloxybutyl)piperazine

C15H32N2O — CID 106008768

IUPAC2-methyl-5-propan-2-yl-1-(4-propan-2-yloxybutyl)piperazine
SMILESCC(C)OCCCCN1CC(C(C)C)NCC1C
InChIInChI=1S/C15H32N2O/c1-12(2)15-11-17(14(5)10-16-15)8-6-7-9-18-13(3)4/h12-16H,6-11H2,1-5H3
InChIKeyVLMLDVGXXCILSM-UHFFFAOYSA-N
MW256.43 g/mol
LogP2.51
Rot. Bonds7

About 2-methyl-5-propan-2-yl-1-(4-propan-2-yloxybutyl)piperazine

2-methyl-5-propan-2-yl-1-(4-propan-2-yloxybutyl)piperazine (PubChem CID 106008768) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is 2-methyl-5-propan-2-yl-1-(4-propan-2-yloxybutyl)piperazine.

Molecular Properties

Compound Name2-methyl-5-propan-2-yl-1-(4-propan-2-yloxybutyl)piperazine
PubChem CID106008768
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC Name2-methyl-5-propan-2-yl-1-(4-propan-2-yloxybutyl)piperazine
SMILESCC(C)OCCCCN1CC(C(C)C)NCC1C
InChIInChI=1S/C15H32N2O/c1-12(2)15-11-17(14(5)10-16-15)8-6-7-9-18-13(3)4/h12-16H,6-11H2,1-5H3
InChIKeyVLMLDVGXXCILSM-UHFFFAOYSA-N
XLogP2.51
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 ≤ 52.51
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-heptyl-2-methyl-5-propan-2-ylpiperazine
CID 64833309
2-methyl-1-(4-methylpentyl)-5-propan-2-ylpiperazine
CID 64937614
1-[3-(cyclopropylmethoxy)propyl]-2-methyl-5-propan-2-ylpiperazine
CID 114097844
1-hex-5-ynyl-2-methyl-5-propan-2-ylpiperazine
CID 106211794
2-methyl-1-(4-propan-2-yloxybutyl)piperazine
CID 106008832
1-(2,2-difluoroethyl)-2-methyl-5-propan-2-ylpiperazine
CID 64831726
5-ethyl-2-methyl-1-(2-propan-2-yloxyethyl)piperazine
CID 64841710
2-methyl-5-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine
CID 79350021
8-methyl-9-(4-propan-2-yloxybutyl)-6,9-diazaspiro[4.5]decane
CID 106008757
5-ethyl-2-propan-2-yl-1-(4-propan-2-yloxybutyl)piperazine
CID 106008717
5-tert-butyl-2-propan-2-yl-1-(4-propan-2-yloxybutyl)piperazine
CID 106008736
2-methyl-5-propan-2-yl-1-prop-2-ynylpiperazine
CID 64937731

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-propan-2-yl-1-(4-propan-2-yloxybutyl)piperazine?
The IUPAC name of 2-methyl-5-propan-2-yl-1-(4-propan-2-yloxybutyl)piperazine (CID 106008768) is 2-methyl-5-propan-2-yl-1-(4-propan-2-yloxybutyl)piperazine.
What is the SMILES notation for 2-methyl-5-propan-2-yl-1-(4-propan-2-yloxybutyl)piperazine?
The canonical SMILES for 2-methyl-5-propan-2-yl-1-(4-propan-2-yloxybutyl)piperazine is CC(C)OCCCCN1CC(C(C)C)NCC1C.
What is the InChIKey of 2-methyl-5-propan-2-yl-1-(4-propan-2-yloxybutyl)piperazine?
The InChIKey is VLMLDVGXXCILSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-12(2)15-11-17(14(5)10-16-15)8-6-7-9-18-13(3)4/h12-16H,6-11H2,1-5H3.
What are the key properties of 2-methyl-5-propan-2-yl-1-(4-propan-2-yloxybutyl)piperazine?
2-methyl-5-propan-2-yl-1-(4-propan-2-yloxybutyl)piperazine has a molecular weight of 256.43 g/mol, XLogP of 2.51, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-propan-2-yl-1-(4-propan-2-yloxybutyl)piperazine is sourced from PubChem (CID 106008768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).