4-methyl-2-methylidene-1-[(E)-2,4,5-trimethylhex-3-en-3-yl]piperazine

C15H28N2 — CID 166774764

IUPAC4-methyl-2-methylidene-1-[(E)-2,4,5-trimethylhex-3-en-3-yl]piperazine
SMILESC=C1CN(C)CCN1/C(=C(\C)C(C)C)C(C)C
InChIInChI=1S/C15H28N2/c1-11(2)14(6)15(12(3)4)17-9-8-16(7)10-13(17)5/h11-12H,5,8-10H2,1-4,6-7H3/b15-14+
InChIKeyCSMPJKKYQPXBDA-CCEZHUSRSA-N
MW236.40 g/mol
LogP3.33
Rot. Bonds3

About 4-methyl-2-methylidene-1-[(E)-2,4,5-trimethylhex-3-en-3-yl]piperazine

4-methyl-2-methylidene-1-[(E)-2,4,5-trimethylhex-3-en-3-yl]piperazine (PubChem CID 166774764) has the molecular formula C15H28N2 and a molecular weight of 236.40 g/mol. Its IUPAC name is 4-methyl-2-methylidene-1-[(E)-2,4,5-trimethylhex-3-en-3-yl]piperazine.

Molecular Properties

Compound Name4-methyl-2-methylidene-1-[(E)-2,4,5-trimethylhex-3-en-3-yl]piperazine
PubChem CID166774764
Molecular FormulaC15H28N2
Molecular Weight236.40 g/mol
Exact Mass236.23
IUPAC Name4-methyl-2-methylidene-1-[(E)-2,4,5-trimethylhex-3-en-3-yl]piperazine
SMILESC=C1CN(C)CCN1/C(=C(\C)C(C)C)C(C)C
InChIInChI=1S/C15H28N2/c1-11(2)14(6)15(12(3)4)17-9-8-16(7)10-13(17)5/h11-12H,5,8-10H2,1-4,6-7H3/b15-14+
InChIKeyCSMPJKKYQPXBDA-CCEZHUSRSA-N
XLogP3.33
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.40
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-methylidene-1-[(E)-2,4,5-trimethylhex-3-en-3-yl]piperazine?
The IUPAC name of 4-methyl-2-methylidene-1-[(E)-2,4,5-trimethylhex-3-en-3-yl]piperazine (CID 166774764) is 4-methyl-2-methylidene-1-[(E)-2,4,5-trimethylhex-3-en-3-yl]piperazine.
What is the SMILES notation for 4-methyl-2-methylidene-1-[(E)-2,4,5-trimethylhex-3-en-3-yl]piperazine?
The canonical SMILES for 4-methyl-2-methylidene-1-[(E)-2,4,5-trimethylhex-3-en-3-yl]piperazine is C=C1CN(C)CCN1/C(=C(\C)C(C)C)C(C)C.
What is the InChIKey of 4-methyl-2-methylidene-1-[(E)-2,4,5-trimethylhex-3-en-3-yl]piperazine?
The InChIKey is CSMPJKKYQPXBDA-CCEZHUSRSA-N. The full InChI is InChI=1S/C15H28N2/c1-11(2)14(6)15(12(3)4)17-9-8-16(7)10-13(17)5/h11-12H,5,8-10H2,1-4,6-7H3/b15-14+.
What are the key properties of 4-methyl-2-methylidene-1-[(E)-2,4,5-trimethylhex-3-en-3-yl]piperazine?
4-methyl-2-methylidene-1-[(E)-2,4,5-trimethylhex-3-en-3-yl]piperazine has a molecular weight of 236.40 g/mol, XLogP of 3.33, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-methylidene-1-[(E)-2,4,5-trimethylhex-3-en-3-yl]piperazine is sourced from PubChem (CID 166774764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).