1-[(2Z)-3,7-dimethylocta-2,6-dienyl]piperazine

C14H26N2 — CID 70588103

IUPAC1-[(2Z)-3,7-dimethylocta-2,6-dienyl]piperazine
SMILESCC(C)=CCC/C(C)=C\CN1CCNCC1
InChIInChI=1S/C14H26N2/c1-13(2)5-4-6-14(3)7-10-16-11-8-15-9-12-16/h5,7,15H,4,6,8-12H2,1-3H3/b14-7-
InChIKeyDXYUBILCMWTMLB-AUWJEWJLSA-N
MW222.38 g/mol
LogP2.58
Rot. Bonds5

About 1-[(2Z)-3,7-dimethylocta-2,6-dienyl]piperazine

1-[(2Z)-3,7-dimethylocta-2,6-dienyl]piperazine (PubChem CID 70588103) has the molecular formula C14H26N2 and a molecular weight of 222.38 g/mol. Its IUPAC name is 1-[(2Z)-3,7-dimethylocta-2,6-dienyl]piperazine.

Molecular Properties

Compound Name1-[(2Z)-3,7-dimethylocta-2,6-dienyl]piperazine
PubChem CID70588103
Molecular FormulaC14H26N2
Molecular Weight222.38 g/mol
Exact Mass222.21
IUPAC Name1-[(2Z)-3,7-dimethylocta-2,6-dienyl]piperazine
SMILESCC(C)=CCC/C(C)=C\CN1CCNCC1
InChIInChI=1S/C14H26N2/c1-13(2)5-4-6-14(3)7-10-16-11-8-15-9-12-16/h5,7,15H,4,6,8-12H2,1-3H3/b14-7-
InChIKeyDXYUBILCMWTMLB-AUWJEWJLSA-N
XLogP2.58
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]-1,4-diazepane
CID 44514516
1-[(2Z)-3,7-dimethylocta-2,6-dienyl]-4-ethylpiperazine
CID 2059248
(2E,6E,10E)-3,7,11,15-tetramethyl-1-piperazin-1-ylhexadeca-2,6,10,14-tetraen-1-one
CID 70430197
1-[(Z)-3-methoxybut-2-enyl]piperazine
CID 166729699
(14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
CID 131954652
2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
CID 173324782
(10E)-2,6,11,15-tetramethylhexadeca-2,6,10,14-tetraene
CID 173158415
5,9,13,17-tetramethyl-1-(2-methylpiperazin-1-yl)octadeca-4,8,12,16-tetraen-1-one
CID 70471801
(6E,10E,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene;2-methyloxaziridine
CID 20839770
(6E,10E,15E)-2,6,10,16,20-pentamethylhenicosa-2,6,10,15,19-pentaene
CID 58662859
1-(3-phenylprop-2-ynyl)-4-(3,7,11-trimethyldodeca-2,6,10-trienyl)piperazine
CID 3051281
(2E)-N-[2-(aziridin-1-yl)ethyl]-3,7-dimethylocta-2,6-dien-1-amine
CID 5365864

Frequently Asked Questions

What is the IUPAC name of 1-[(2Z)-3,7-dimethylocta-2,6-dienyl]piperazine?
The IUPAC name of 1-[(2Z)-3,7-dimethylocta-2,6-dienyl]piperazine (CID 70588103) is 1-[(2Z)-3,7-dimethylocta-2,6-dienyl]piperazine.
What is the SMILES notation for 1-[(2Z)-3,7-dimethylocta-2,6-dienyl]piperazine?
The canonical SMILES for 1-[(2Z)-3,7-dimethylocta-2,6-dienyl]piperazine is CC(C)=CCC/C(C)=C\CN1CCNCC1.
What is the InChIKey of 1-[(2Z)-3,7-dimethylocta-2,6-dienyl]piperazine?
The InChIKey is DXYUBILCMWTMLB-AUWJEWJLSA-N. The full InChI is InChI=1S/C14H26N2/c1-13(2)5-4-6-14(3)7-10-16-11-8-15-9-12-16/h5,7,15H,4,6,8-12H2,1-3H3/b14-7-.
What are the key properties of 1-[(2Z)-3,7-dimethylocta-2,6-dienyl]piperazine?
1-[(2Z)-3,7-dimethylocta-2,6-dienyl]piperazine has a molecular weight of 222.38 g/mol, XLogP of 2.58, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2Z)-3,7-dimethylocta-2,6-dienyl]piperazine is sourced from PubChem (CID 70588103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).