5-cyclopropyl-2-methyl-1-[2-(2-methylprop-2-enoxy)ethyl]piperazine

C14H26N2O — CID 114469746

IUPAC5-cyclopropyl-2-methyl-1-[2-(2-methylprop-2-enoxy)ethyl]piperazine
SMILESC=C(C)COCCN1CC(C2CC2)NCC1C
InChIInChI=1S/C14H26N2O/c1-11(2)10-17-7-6-16-9-14(13-4-5-13)15-8-12(16)3/h12-15H,1,4-10H2,2-3H3
InChIKeyRBYVNQBFYABHMR-UHFFFAOYSA-N
MW238.37 g/mol
LogP1.65
Rot. Bonds6

About 5-cyclopropyl-2-methyl-1-[2-(2-methylprop-2-enoxy)ethyl]piperazine

5-cyclopropyl-2-methyl-1-[2-(2-methylprop-2-enoxy)ethyl]piperazine (PubChem CID 114469746) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 5-cyclopropyl-2-methyl-1-[2-(2-methylprop-2-enoxy)ethyl]piperazine.

Molecular Properties

Compound Name5-cyclopropyl-2-methyl-1-[2-(2-methylprop-2-enoxy)ethyl]piperazine
PubChem CID114469746
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name5-cyclopropyl-2-methyl-1-[2-(2-methylprop-2-enoxy)ethyl]piperazine
SMILESC=C(C)COCCN1CC(C2CC2)NCC1C
InChIInChI=1S/C14H26N2O/c1-11(2)10-17-7-6-16-9-14(13-4-5-13)15-8-12(16)3/h12-15H,1,4-10H2,2-3H3
InChIKeyRBYVNQBFYABHMR-UHFFFAOYSA-N
XLogP1.65
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-cyclopropyl-1-[2-(2-methoxyethoxy)ethyl]-2-methylpiperazine
CID 64862014
4-(5-cyclopropyl-2-methylpiperazin-1-yl)-N,N-dimethylbutan-1-amine
CID 64946394
5-cyclopropyl-2-methyl-1-(3-methylsulfonylpropyl)piperazine
CID 64862396
5-cyclopropyl-1-hex-5-ynyl-2-methylpiperazine
CID 106211645
5-cyclohexyl-1-(3-methoxypropyl)-2-methylpiperazine
CID 64860169
3-cyclopropyl-7-methyl-1-[2-(3-methylbutoxy)ethyl]-1,4-diazepane
CID 64871414
2,5-dicyclopropyl-1-[2-(2-methylpropoxy)ethyl]piperazine
CID 106458819
3-methyl-1-[2-(2-methylprop-2-enoxy)ethyl]-1,4-diazepane
CID 114469706
5-butan-2-yl-2-ethyl-1-[2-(2-methylprop-2-enoxy)ethyl]piperazine
CID 114469740
1-[2-(cyclopenten-1-yl)ethyl]-5-cyclopropyl-2-methylpiperazine
CID 114153752
2-[2-(5-cyclopropyl-2-methylpiperazin-1-yl)ethyl]-1,3-thiazole
CID 64942156
2-butan-2-yl-5-cyclopropyl-1-(2-propoxyethyl)piperazine
CID 106458816

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-2-methyl-1-[2-(2-methylprop-2-enoxy)ethyl]piperazine?
The IUPAC name of 5-cyclopropyl-2-methyl-1-[2-(2-methylprop-2-enoxy)ethyl]piperazine (CID 114469746) is 5-cyclopropyl-2-methyl-1-[2-(2-methylprop-2-enoxy)ethyl]piperazine.
What is the SMILES notation for 5-cyclopropyl-2-methyl-1-[2-(2-methylprop-2-enoxy)ethyl]piperazine?
The canonical SMILES for 5-cyclopropyl-2-methyl-1-[2-(2-methylprop-2-enoxy)ethyl]piperazine is C=C(C)COCCN1CC(C2CC2)NCC1C.
What is the InChIKey of 5-cyclopropyl-2-methyl-1-[2-(2-methylprop-2-enoxy)ethyl]piperazine?
The InChIKey is RBYVNQBFYABHMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-11(2)10-17-7-6-16-9-14(13-4-5-13)15-8-12(16)3/h12-15H,1,4-10H2,2-3H3.
What are the key properties of 5-cyclopropyl-2-methyl-1-[2-(2-methylprop-2-enoxy)ethyl]piperazine?
5-cyclopropyl-2-methyl-1-[2-(2-methylprop-2-enoxy)ethyl]piperazine has a molecular weight of 238.37 g/mol, XLogP of 1.65, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-2-methyl-1-[2-(2-methylprop-2-enoxy)ethyl]piperazine is sourced from PubChem (CID 114469746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).