1-[(Z,2E)-2-ethylidenepent-3-enyl]-4-methylpiperazine

C12H22N2 — CID 142275826

IUPAC1-[(Z,2E)-2-ethylidenepent-3-enyl]-4-methylpiperazine
SMILESC/C=C\C(=C/C)CN1CCN(C)CC1
InChIInChI=1S/C12H22N2/c1-4-6-12(5-2)11-14-9-7-13(3)8-10-14/h4-6H,7-11H2,1-3H3/b6-4-,12-5+
InChIKeyARLRRTRMXCLDRY-GLNLJRCCSA-N
MW194.32 g/mol
LogP1.76
Rot. Bonds3

About 1-[(Z,2E)-2-ethylidenepent-3-enyl]-4-methylpiperazine

1-[(Z,2E)-2-ethylidenepent-3-enyl]-4-methylpiperazine (PubChem CID 142275826) has the molecular formula C12H22N2 and a molecular weight of 194.32 g/mol. Its IUPAC name is 1-[(Z,2E)-2-ethylidenepent-3-enyl]-4-methylpiperazine.

Molecular Properties

Compound Name1-[(Z,2E)-2-ethylidenepent-3-enyl]-4-methylpiperazine
PubChem CID142275826
Molecular FormulaC12H22N2
Molecular Weight194.32 g/mol
Exact Mass194.18
IUPAC Name1-[(Z,2E)-2-ethylidenepent-3-enyl]-4-methylpiperazine
SMILESC/C=C\C(=C/C)CN1CCN(C)CC1
InChIInChI=1S/C12H22N2/c1-4-6-12(5-2)11-14-9-7-13(3)8-10-14/h4-6H,7-11H2,1-3H3/b6-4-,12-5+
InChIKeyARLRRTRMXCLDRY-GLNLJRCCSA-N
XLogP1.76
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-[(Z,2E)-2-ethylidenepent-3-enyl]-4-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

Piperazine, 1-allyl-4-(3,7,11-trimethyl-2,6,10-dodecatrienyl)-
CID 6446858
2,6-Bis(dimethylaminomethyl)phenyllithium
CID 11830389
2-Diethylaminomethylphenyllithium
CID 21399648
1-[2-Ethylidene-3-(trifluoromethyl)pent-3-enyl]-4-methylpiperazine
CID 123401847
1-Methyl-4-[2-(1,1,1-trifluoropropan-2-ylidene)pent-3-enyl]piperazine
CID 123611666
1-Ethyl-4-[2-methyl-3-(trifluoromethyl)penta-2,4-dienyl]piperazine
CID 123728932
1-[2-Ethenyl-3-(trifluoromethyl)penta-2,4-dienyl]-4-ethylpiperazine
CID 123762068
1-[2-(3,3-Difluorobutan-2-ylidene)hex-3-enyl]-4-ethylpiperazine
CID 123900297
1-Methyl-4-[2-(3,3,3-trifluoroprop-1-en-2-yl)but-2-enyl]piperazine
CID 123958710
1-Methyl-4-[2-(3,3,3-trifluoroprop-1-en-2-yl)penta-2,4-dienyl]piperazine
CID 124021711
1-[(2Z)-2-[(E)-1-fluoroprop-1-enyl]penta-2,4-dienyl]-4-methylpiperazine
CID 129043271
N'-[(Z)-2-ethenyl-3-fluoropent-2-enyl]-N,N'-diethyl-N-methylethane-1,2-diamine
CID 139566303

Frequently Asked Questions

What is the IUPAC name of 1-[(Z,2E)-2-ethylidenepent-3-enyl]-4-methylpiperazine?
The IUPAC name of 1-[(Z,2E)-2-ethylidenepent-3-enyl]-4-methylpiperazine (CID 142275826) is 1-[(Z,2E)-2-ethylidenepent-3-enyl]-4-methylpiperazine.
What is the SMILES notation for 1-[(Z,2E)-2-ethylidenepent-3-enyl]-4-methylpiperazine?
The canonical SMILES for 1-[(Z,2E)-2-ethylidenepent-3-enyl]-4-methylpiperazine is C/C=C\C(=C/C)CN1CCN(C)CC1.
What is the InChIKey of 1-[(Z,2E)-2-ethylidenepent-3-enyl]-4-methylpiperazine?
The InChIKey is ARLRRTRMXCLDRY-GLNLJRCCSA-N. The full InChI is InChI=1S/C12H22N2/c1-4-6-12(5-2)11-14-9-7-13(3)8-10-14/h4-6H,7-11H2,1-3H3/b6-4-,12-5+.
What are the key properties of 1-[(Z,2E)-2-ethylidenepent-3-enyl]-4-methylpiperazine?
1-[(Z,2E)-2-ethylidenepent-3-enyl]-4-methylpiperazine has a molecular weight of 194.32 g/mol, XLogP of 1.76, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(Z,2E)-2-ethylidenepent-3-enyl]-4-methylpiperazine is sourced from PubChem (CID 142275826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).