1-[(Z)-2-propan-2-ylidenepent-3-enyl]piperazine

C12H22N2 — CID 129253893

IUPAC1-[(Z)-2-propan-2-ylidenepent-3-enyl]piperazine
SMILESC/C=C\C(CN1CCNCC1)=C(C)C
InChIInChI=1S/C12H22N2/c1-4-5-12(11(2)3)10-14-8-6-13-7-9-14/h4-5,13H,6-10H2,1-3H3/b5-4-
InChIKeyUYLJVOLFBZMSJU-PLNGDYQASA-N
MW194.32 g/mol
LogP1.80
Rot. Bonds3

About 1-[(Z)-2-propan-2-ylidenepent-3-enyl]piperazine

1-[(Z)-2-propan-2-ylidenepent-3-enyl]piperazine (PubChem CID 129253893) has the molecular formula C12H22N2 and a molecular weight of 194.32 g/mol. Its IUPAC name is 1-[(Z)-2-propan-2-ylidenepent-3-enyl]piperazine.

Molecular Properties

Compound Name1-[(Z)-2-propan-2-ylidenepent-3-enyl]piperazine
PubChem CID129253893
Molecular FormulaC12H22N2
Molecular Weight194.32 g/mol
Exact Mass194.18
IUPAC Name1-[(Z)-2-propan-2-ylidenepent-3-enyl]piperazine
SMILESC/C=C\C(CN1CCNCC1)=C(C)C
InChIInChI=1S/C12H22N2/c1-4-5-12(11(2)3)10-14-8-6-13-7-9-14/h4-5,13H,6-10H2,1-3H3/b5-4-
InChIKeyUYLJVOLFBZMSJU-PLNGDYQASA-N
XLogP1.80
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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1-[(2Z)-2-ethenyl-5-methyl-3-(trifluoromethyl)hexa-2,4-dienyl]-3-methylpiperazine
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CID 123832271
1-[(2Z)-2-[(E)-1-fluoroprop-1-enyl]penta-2,4-dienyl]-4-methylpiperazine
CID 129043271
1-[(4,4-Difluorocyclohexa-1,5-dien-1-yl)methyl]piperazine
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(2S,5R)-1-[(2E,3Z)-2-ethylidene-5-fluorohexa-3,5-dienyl]-2,5-dimethylpiperazine
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2-[4-[(2-Chloro-7-fluorocyclohepta-1,3,6-trien-1-yl)methyl]piperazin-1-yl]ethanamine
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Ethane;1-[[2-(trifluoromethyl)cyclohepta-1,3,5-trien-1-yl]methyl]piperazine
CID 144657307
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Frequently Asked Questions

What is the IUPAC name of 1-[(Z)-2-propan-2-ylidenepent-3-enyl]piperazine?
The IUPAC name of 1-[(Z)-2-propan-2-ylidenepent-3-enyl]piperazine (CID 129253893) is 1-[(Z)-2-propan-2-ylidenepent-3-enyl]piperazine.
What is the SMILES notation for 1-[(Z)-2-propan-2-ylidenepent-3-enyl]piperazine?
The canonical SMILES for 1-[(Z)-2-propan-2-ylidenepent-3-enyl]piperazine is C/C=C\C(CN1CCNCC1)=C(C)C.
What is the InChIKey of 1-[(Z)-2-propan-2-ylidenepent-3-enyl]piperazine?
The InChIKey is UYLJVOLFBZMSJU-PLNGDYQASA-N. The full InChI is InChI=1S/C12H22N2/c1-4-5-12(11(2)3)10-14-8-6-13-7-9-14/h4-5,13H,6-10H2,1-3H3/b5-4-.
What are the key properties of 1-[(Z)-2-propan-2-ylidenepent-3-enyl]piperazine?
1-[(Z)-2-propan-2-ylidenepent-3-enyl]piperazine has a molecular weight of 194.32 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(Z)-2-propan-2-ylidenepent-3-enyl]piperazine is sourced from PubChem (CID 129253893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).