(Z)-1-piperazin-1-ylhex-2-en-1-imine

C10H19N3 — CID 176921342

IUPAC(Z)-1-piperazin-1-ylhex-2-en-1-imine
SMILES[H]/N=C(\C=C/CCC)N1CCNCC1
InChIInChI=1S/C10H19N3/c1-2-3-4-5-10(11)13-8-6-12-7-9-13/h4-5,11-12H,2-3,6-9H2,1H3/b5-4-,11-10+
InChIKeyZYVGLBBAYVOTDM-JWPKELMXSA-N
MW181.28 g/mol
LogP1.23
Rot. Bonds3

About (Z)-1-piperazin-1-ylhex-2-en-1-imine

(Z)-1-piperazin-1-ylhex-2-en-1-imine (PubChem CID 176921342) has the molecular formula C10H19N3 and a molecular weight of 181.28 g/mol. Its IUPAC name is (Z)-1-piperazin-1-ylhex-2-en-1-imine.

Molecular Properties

Compound Name(Z)-1-piperazin-1-ylhex-2-en-1-imine
PubChem CID176921342
Molecular FormulaC10H19N3
Molecular Weight181.28 g/mol
Exact Mass181.16
IUPAC Name(Z)-1-piperazin-1-ylhex-2-en-1-imine
SMILES[H]/N=C(\C=C/CCC)N1CCNCC1
InChIInChI=1S/C10H19N3/c1-2-3-4-5-10(11)13-8-6-12-7-9-13/h4-5,11-12H,2-3,6-9H2,1H3/b5-4-,11-10+
InChIKeyZYVGLBBAYVOTDM-JWPKELMXSA-N
XLogP1.23
TPSA39.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

(E)-3,5-dimethyl-1-piperazin-1-ylhex-2-en-1-imine;ethane
CID 166128167
(Z)-N-(1-amino-2-phenylethylidene)-4-imino-4-piperazin-1-ylbut-2-enimidamide
CID 162386622
N-methanimidoyl-N-methylpiperazine-1-carboximidamide;molecular hydrogen
CID 170740622
(E,2E)-2-ethylidene-4-[[(2E,3Z)-3-ethylidene-2-[(Z)-hex-2-enylidene]pyrrol-1-yl]methyl]-5-methyl-1-piperazin-1-ylhept-3-en-1-imine
CID 145324460
(E)-3-piperazin-1-ylbut-2-en-1-imine
CID 142245533
N-ethylpiperazine-1-carboxamide
CID 9207783
1-piperazin-1-ylbutan-1-one;hydrochloride
CID 67460380
N-ethylpiperazine-1-carbothioamide
CID 13077529
1-piperazin-1-yl-1-propylguanidine
CID 68840015
tert-butyl formate;piperazine-1-carboximidamide;hydrochloride
CID 174785913
1-[(E)-2-ethylhex-2-enyl]piperazine
CID 20521851
(2E)-N,N-dimethyl-4-piperazin-1-ylpenta-2,4-dien-1-amine
CID 139338168

Frequently Asked Questions

What is the IUPAC name of (Z)-1-piperazin-1-ylhex-2-en-1-imine?
The IUPAC name of (Z)-1-piperazin-1-ylhex-2-en-1-imine (CID 176921342) is (Z)-1-piperazin-1-ylhex-2-en-1-imine.
What is the SMILES notation for (Z)-1-piperazin-1-ylhex-2-en-1-imine?
The canonical SMILES for (Z)-1-piperazin-1-ylhex-2-en-1-imine is [H]/N=C(\C=C/CCC)N1CCNCC1.
What is the InChIKey of (Z)-1-piperazin-1-ylhex-2-en-1-imine?
The InChIKey is ZYVGLBBAYVOTDM-JWPKELMXSA-N. The full InChI is InChI=1S/C10H19N3/c1-2-3-4-5-10(11)13-8-6-12-7-9-13/h4-5,11-12H,2-3,6-9H2,1H3/b5-4-,11-10+.
What are the key properties of (Z)-1-piperazin-1-ylhex-2-en-1-imine?
(Z)-1-piperazin-1-ylhex-2-en-1-imine has a molecular weight of 181.28 g/mol, XLogP of 1.23, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-piperazin-1-ylhex-2-en-1-imine is sourced from PubChem (CID 176921342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).