1-[(Z)-1-cyclopropylidene-5,6-bis(ethenyl)-2-methylnon-5-enyl]piperazine

C21H34N2 — CID 143629797

IUPAC1-[(Z)-1-cyclopropylidene-5,6-bis(ethenyl)-2-methylnon-5-enyl]piperazine
SMILESC=C/C(CCC)=C(\C=C)CCC(C)C(=C1CC1)N1CCNCC1
InChIInChI=1S/C21H34N2/c1-5-8-18(6-2)19(7-3)10-9-17(4)21(20-11-12-20)23-15-13-22-14-16-23/h6-7,17,22H,2-3,5,8-16H2,1,4H3/b19-18-
InChIKeyFJYCSSCTRFZXCV-HNENSFHCSA-N
MW314.52 g/mol
LogP4.82
Rot. Bonds9

About 1-[(Z)-1-cyclopropylidene-5,6-bis(ethenyl)-2-methylnon-5-enyl]piperazine

1-[(Z)-1-cyclopropylidene-5,6-bis(ethenyl)-2-methylnon-5-enyl]piperazine (PubChem CID 143629797) has the molecular formula C21H34N2 and a molecular weight of 314.52 g/mol. Its IUPAC name is 1-[(Z)-1-cyclopropylidene-5,6-bis(ethenyl)-2-methylnon-5-enyl]piperazine.

Molecular Properties

Compound Name1-[(Z)-1-cyclopropylidene-5,6-bis(ethenyl)-2-methylnon-5-enyl]piperazine
PubChem CID143629797
Molecular FormulaC21H34N2
Molecular Weight314.52 g/mol
Exact Mass314.27
IUPAC Name1-[(Z)-1-cyclopropylidene-5,6-bis(ethenyl)-2-methylnon-5-enyl]piperazine
SMILESC=C/C(CCC)=C(\C=C)CCC(C)C(=C1CC1)N1CCNCC1
InChIInChI=1S/C21H34N2/c1-5-8-18(6-2)19(7-3)10-9-17(4)21(20-11-12-20)23-15-13-22-14-16-23/h6-7,17,22H,2-3,5,8-16H2,1,4H3/b19-18-
InChIKeyFJYCSSCTRFZXCV-HNENSFHCSA-N
XLogP4.82
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.52
LogP ≤ 54.82
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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ethane;4-methyl-1-piperazin-1-ylpentan-1-one
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CID 10631004
1-[(3S)-3-methylpiperazin-1-yl]butan-1-one
CID 11355735
(2S)-2-amino-1-piperazin-1-ylpentan-1-one
CID 93255588
1-heptan-2-ylpiperazine
CID 61464712
1-piperazin-1-ylpentadecan-1-one
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Frequently Asked Questions

What is the IUPAC name of 1-[(Z)-1-cyclopropylidene-5,6-bis(ethenyl)-2-methylnon-5-enyl]piperazine?
The IUPAC name of 1-[(Z)-1-cyclopropylidene-5,6-bis(ethenyl)-2-methylnon-5-enyl]piperazine (CID 143629797) is 1-[(Z)-1-cyclopropylidene-5,6-bis(ethenyl)-2-methylnon-5-enyl]piperazine.
What is the SMILES notation for 1-[(Z)-1-cyclopropylidene-5,6-bis(ethenyl)-2-methylnon-5-enyl]piperazine?
The canonical SMILES for 1-[(Z)-1-cyclopropylidene-5,6-bis(ethenyl)-2-methylnon-5-enyl]piperazine is C=C/C(CCC)=C(\C=C)CCC(C)C(=C1CC1)N1CCNCC1.
What is the InChIKey of 1-[(Z)-1-cyclopropylidene-5,6-bis(ethenyl)-2-methylnon-5-enyl]piperazine?
The InChIKey is FJYCSSCTRFZXCV-HNENSFHCSA-N. The full InChI is InChI=1S/C21H34N2/c1-5-8-18(6-2)19(7-3)10-9-17(4)21(20-11-12-20)23-15-13-22-14-16-23/h6-7,17,22H,2-3,5,8-16H2,1,4H3/b19-18-.
What are the key properties of 1-[(Z)-1-cyclopropylidene-5,6-bis(ethenyl)-2-methylnon-5-enyl]piperazine?
1-[(Z)-1-cyclopropylidene-5,6-bis(ethenyl)-2-methylnon-5-enyl]piperazine has a molecular weight of 314.52 g/mol, XLogP of 4.82, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(Z)-1-cyclopropylidene-5,6-bis(ethenyl)-2-methylnon-5-enyl]piperazine is sourced from PubChem (CID 143629797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).