1-methyl-4-[(2Z,4E)-6-methylideneocta-2,4-dien-4-yl]piperazine

C14H24N2 — CID 167243119

IUPAC1-methyl-4-[(2Z,4E)-6-methylideneocta-2,4-dien-4-yl]piperazine
SMILESC=C(/C=C(\C=C/C)N1CCN(C)CC1)CC
InChIInChI=1S/C14H24N2/c1-5-7-14(12-13(3)6-2)16-10-8-15(4)9-11-16/h5,7,12H,3,6,8-11H2,1-2,4H3/b7-5-,14-12+
InChIKeyAGUPCVQFSCLTKR-LJRDKERCSA-N
MW220.36 g/mol
LogP2.66
Rot. Bonds4

About 1-methyl-4-[(2Z,4E)-6-methylideneocta-2,4-dien-4-yl]piperazine

1-methyl-4-[(2Z,4E)-6-methylideneocta-2,4-dien-4-yl]piperazine (PubChem CID 167243119) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is 1-methyl-4-[(2Z,4E)-6-methylideneocta-2,4-dien-4-yl]piperazine.

Molecular Properties

Compound Name1-methyl-4-[(2Z,4E)-6-methylideneocta-2,4-dien-4-yl]piperazine
PubChem CID167243119
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC Name1-methyl-4-[(2Z,4E)-6-methylideneocta-2,4-dien-4-yl]piperazine
SMILESC=C(/C=C(\C=C/C)N1CCN(C)CC1)CC
InChIInChI=1S/C14H24N2/c1-5-7-14(12-13(3)6-2)16-10-8-15(4)9-11-16/h5,7,12H,3,6,8-11H2,1-2,4H3/b7-5-,14-12+
InChIKeyAGUPCVQFSCLTKR-LJRDKERCSA-N
XLogP2.66
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-[(2Z,4E)-6-methylideneocta-2,4-dien-4-yl]morpholine
CID 144607333
(2E,3E,5Z)-2-ethylidene-4-(4-methylpiperazin-1-yl)hepta-3,5-dienenitrile
CID 142101610
(3Z,5E)-5-(4-methylpiperazin-1-yl)hepta-1,3,5-trien-2-amine
CID 166686108
1-methyl-4-pent-2-en-3-ylpiperazine
CID 123450021
ethane;1-[(3Z,5Z)-hepta-1,3,5-trien-2-yl]-4-methylpiperazine
CID 142829570
(3Z)-5-(4-methylpiperazin-1-yl)-3-propylhexa-1,3,5-trien-2-amine
CID 155721811
1-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]piperazin-1-yl]ethanone
CID 144786751
1-methyl-4-[[(6Z)-6-(2-methylidenebutylidene)cyclohexa-2,4-dien-1-ylidene]-(4-methylpiperazin-1-yl)methyl]piperazine
CID 10338244
N-ethenyl-1-(4-methylpiperazin-1-yl)propan-1-imine
CID 170065630
N-[(3E,5Z)-4-bromohepta-1,3,5-trien-2-yl]-3-(4-methylpiperazin-1-yl)propanamide
CID 168985200
8-methylidenedeca-2,6-diene
CID 123418054
hexa-1,3-diene;4-methylidenehex-2-ene
CID 174375907

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-[(2Z,4E)-6-methylideneocta-2,4-dien-4-yl]piperazine?
The IUPAC name of 1-methyl-4-[(2Z,4E)-6-methylideneocta-2,4-dien-4-yl]piperazine (CID 167243119) is 1-methyl-4-[(2Z,4E)-6-methylideneocta-2,4-dien-4-yl]piperazine.
What is the SMILES notation for 1-methyl-4-[(2Z,4E)-6-methylideneocta-2,4-dien-4-yl]piperazine?
The canonical SMILES for 1-methyl-4-[(2Z,4E)-6-methylideneocta-2,4-dien-4-yl]piperazine is C=C(/C=C(\C=C/C)N1CCN(C)CC1)CC.
What is the InChIKey of 1-methyl-4-[(2Z,4E)-6-methylideneocta-2,4-dien-4-yl]piperazine?
The InChIKey is AGUPCVQFSCLTKR-LJRDKERCSA-N. The full InChI is InChI=1S/C14H24N2/c1-5-7-14(12-13(3)6-2)16-10-8-15(4)9-11-16/h5,7,12H,3,6,8-11H2,1-2,4H3/b7-5-,14-12+.
What are the key properties of 1-methyl-4-[(2Z,4E)-6-methylideneocta-2,4-dien-4-yl]piperazine?
1-methyl-4-[(2Z,4E)-6-methylideneocta-2,4-dien-4-yl]piperazine has a molecular weight of 220.36 g/mol, XLogP of 2.66, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-[(2Z,4E)-6-methylideneocta-2,4-dien-4-yl]piperazine is sourced from PubChem (CID 167243119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).