2-ethyl-4-hex-1-en-2-yl-1-methylpiperazine

C13H26N2 — CID 129029335

IUPAC2-ethyl-4-hex-1-en-2-yl-1-methylpiperazine
SMILESC=C(CCCC)N1CCN(C)C(CC)C1
InChIInChI=1S/C13H26N2/c1-5-7-8-12(3)15-10-9-14(4)13(6-2)11-15/h13H,3,5-11H2,1-2,4H3
InChIKeyDCCVFEJYKSKQCS-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.72
Rot. Bonds5

About 2-ethyl-4-hex-1-en-2-yl-1-methylpiperazine

2-ethyl-4-hex-1-en-2-yl-1-methylpiperazine (PubChem CID 129029335) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 2-ethyl-4-hex-1-en-2-yl-1-methylpiperazine.

Molecular Properties

Compound Name2-ethyl-4-hex-1-en-2-yl-1-methylpiperazine
PubChem CID129029335
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name2-ethyl-4-hex-1-en-2-yl-1-methylpiperazine
SMILESC=C(CCCC)N1CCN(C)C(CC)C1
InChIInChI=1S/C13H26N2/c1-5-7-8-12(3)15-10-9-14(4)13(6-2)11-15/h13H,3,5-11H2,1-2,4H3
InChIKeyDCCVFEJYKSKQCS-UHFFFAOYSA-N
XLogP2.72
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-ethyl-4-hex-1-en-2-yl-1-methylpiperazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-Methyl-2-methylenepiperidine
CID 20522178
4-Hex-1-en-2-yl-1-methyl-2-(trifluoromethyl)piperazine
CID 129028869
1-(6-Fluorohex-1-en-2-yl)-4-methylpiperazine
CID 129029259
1-(5-Fluoropent-1-en-2-yl)-4-methylpiperazine
CID 129029398
1-(5,5-Difluorohex-1-en-2-yl)-4-propan-2-ylpiperazine
CID 166844070
(3S,5R)-1-but-1-en-2-yl-3-fluoro-5-(2-methylidenepyrrolidin-1-yl)piperidine
CID 174317333
(3R,5S)-1-(3-aminoprop-1-en-2-yl)-N-but-1-en-2-yl-5-fluoro-N-propylpiperidin-3-amine
CID 174317421
1-(1-Cyclohexen-1-yl)-4-methylpiperazine
CID 15363494
3-Fluoro-2-methylidene-1-propan-2-ylpiperidine
CID 171846776
1-(Cyclopenten-1-yl)-4-methylpiperazine
CID 15363491
1-But-1-en-2-ylpiperidine
CID 20715115
1,1-Dimethyl-2-methylidenepiperidin-1-ium
CID 23437402

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4-hex-1-en-2-yl-1-methylpiperazine?
The IUPAC name of 2-ethyl-4-hex-1-en-2-yl-1-methylpiperazine (CID 129029335) is 2-ethyl-4-hex-1-en-2-yl-1-methylpiperazine.
What is the SMILES notation for 2-ethyl-4-hex-1-en-2-yl-1-methylpiperazine?
The canonical SMILES for 2-ethyl-4-hex-1-en-2-yl-1-methylpiperazine is C=C(CCCC)N1CCN(C)C(CC)C1.
What is the InChIKey of 2-ethyl-4-hex-1-en-2-yl-1-methylpiperazine?
The InChIKey is DCCVFEJYKSKQCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-5-7-8-12(3)15-10-9-14(4)13(6-2)11-15/h13H,3,5-11H2,1-2,4H3.
What are the key properties of 2-ethyl-4-hex-1-en-2-yl-1-methylpiperazine?
2-ethyl-4-hex-1-en-2-yl-1-methylpiperazine has a molecular weight of 210.36 g/mol, XLogP of 2.72, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-hex-1-en-2-yl-1-methylpiperazine is sourced from PubChem (CID 129029335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).