1-(4-methyl-1-pent-2-enyl-4,5-dihydroimidazol-2-yl)piperazine

C13H24N4 — CID 90905574

IUPAC1-(4-methyl-1-pent-2-enyl-4,5-dihydroimidazol-2-yl)piperazine
SMILESCCC=CCN1CC(C)N=C1N1CCNCC1
InChIInChI=1S/C13H24N4/c1-3-4-5-8-17-11-12(2)15-13(17)16-9-6-14-7-10-16/h4-5,12,14H,3,6-11H2,1-2H3
InChIKeyJCTQIQVWMJYGSD-UHFFFAOYSA-N
MW236.36 g/mol
LogP0.92
Rot. Bonds3

About 1-(4-methyl-1-pent-2-enyl-4,5-dihydroimidazol-2-yl)piperazine

1-(4-methyl-1-pent-2-enyl-4,5-dihydroimidazol-2-yl)piperazine (PubChem CID 90905574) has the molecular formula C13H24N4 and a molecular weight of 236.36 g/mol. Its IUPAC name is 1-(4-methyl-1-pent-2-enyl-4,5-dihydroimidazol-2-yl)piperazine.

Molecular Properties

Compound Name1-(4-methyl-1-pent-2-enyl-4,5-dihydroimidazol-2-yl)piperazine
PubChem CID90905574
Molecular FormulaC13H24N4
Molecular Weight236.36 g/mol
Exact Mass236.20
IUPAC Name1-(4-methyl-1-pent-2-enyl-4,5-dihydroimidazol-2-yl)piperazine
SMILESCCC=CCN1CC(C)N=C1N1CCNCC1
InChIInChI=1S/C13H24N4/c1-3-4-5-8-17-11-12(2)15-13(17)16-9-6-14-7-10-16/h4-5,12,14H,3,6-11H2,1-2H3
InChIKeyJCTQIQVWMJYGSD-UHFFFAOYSA-N
XLogP0.92
TPSA30.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-methyl-N-[(E)-pent-3-enyl]-4-(1,1,1-trifluoropropan-2-yl)piperazine-1-carboximidamide;hydroiodide
CID 109376078
N'-methyl-N-[(E)-pent-3-enyl]-4-(1,1,1-trifluoropropan-2-yl)piperazine-1-carboximidamide
CID 109376079
N-ethyl-N'-[(E)-pent-3-enyl]-4-(1,1,1-trifluoropropan-2-yl)piperazine-1-carboximidamide;hydroiodide
CID 109377688
N-ethyl-N'-[(E)-pent-3-enyl]-4-(1,1,1-trifluoropropan-2-yl)piperazine-1-carboximidamide
CID 109377689
6-[(3R)-3,4-dimethylpiperazin-1-yl]-4-[(Z)-prop-1-enyl]-1,4,5,6-tetrahydropyrimidine
CID 90453784
1-(1-But-2-enyl-4-methyl-4,5-dihydroimidazol-2-yl)piperazine
CID 90847682
1-[4-Methyl-1-(3-methylbut-2-enyl)-4,5-dihydroimidazol-2-yl]piperazine
CID 91388993
N'-[(E)-6-(4-methylpiperazin-1-yl)hex-2-enyl]-N-prop-2-enylmethanimidamide
CID 139305674
6-prop-1-enyl-3,4,6,7,8,9-hexahydro-2H-pyrimido[1,2-a]pyrimidine
CID 141271071
N-methyl-1-[(E)-pent-2-enyl]imidazolidin-2-imine
CID 166858609
N-tert-butyl-1-[(E)-pent-2-enyl]-4,5-dihydroimidazol-2-amine
CID 168819944
1-[(E)-pent-2-enyl]-N-propan-2-yl-4,5-dihydroimidazol-2-amine
CID 169970166

Frequently Asked Questions

What is the IUPAC name of 1-(4-methyl-1-pent-2-enyl-4,5-dihydroimidazol-2-yl)piperazine?
The IUPAC name of 1-(4-methyl-1-pent-2-enyl-4,5-dihydroimidazol-2-yl)piperazine (CID 90905574) is 1-(4-methyl-1-pent-2-enyl-4,5-dihydroimidazol-2-yl)piperazine.
What is the SMILES notation for 1-(4-methyl-1-pent-2-enyl-4,5-dihydroimidazol-2-yl)piperazine?
The canonical SMILES for 1-(4-methyl-1-pent-2-enyl-4,5-dihydroimidazol-2-yl)piperazine is CCC=CCN1CC(C)N=C1N1CCNCC1.
What is the InChIKey of 1-(4-methyl-1-pent-2-enyl-4,5-dihydroimidazol-2-yl)piperazine?
The InChIKey is JCTQIQVWMJYGSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4/c1-3-4-5-8-17-11-12(2)15-13(17)16-9-6-14-7-10-16/h4-5,12,14H,3,6-11H2,1-2H3.
What are the key properties of 1-(4-methyl-1-pent-2-enyl-4,5-dihydroimidazol-2-yl)piperazine?
1-(4-methyl-1-pent-2-enyl-4,5-dihydroimidazol-2-yl)piperazine has a molecular weight of 236.36 g/mol, XLogP of 0.92, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methyl-1-pent-2-enyl-4,5-dihydroimidazol-2-yl)piperazine is sourced from PubChem (CID 90905574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).