2,5-dimethyl-2-prop-2-enylpiperazine

C9H18N2 — CID 91377564

IUPAC2,5-dimethyl-2-prop-2-enylpiperazine
SMILESC=CCC1(C)CNC(C)CN1
InChIInChI=1S/C9H18N2/c1-4-5-9(3)7-10-8(2)6-11-9/h4,8,10-11H,1,5-7H2,2-3H3
InChIKeyKSZGCZAYAQCLGJ-UHFFFAOYSA-N
MW154.26 g/mol
LogP0.90
Rot. Bonds2

About 2,5-dimethyl-2-prop-2-enylpiperazine

2,5-dimethyl-2-prop-2-enylpiperazine (PubChem CID 91377564) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is 2,5-dimethyl-2-prop-2-enylpiperazine.

Molecular Properties

Compound Name2,5-dimethyl-2-prop-2-enylpiperazine
PubChem CID91377564
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name2,5-dimethyl-2-prop-2-enylpiperazine
SMILESC=CCC1(C)CNC(C)CN1
InChIInChI=1S/C9H18N2/c1-4-5-9(3)7-10-8(2)6-11-9/h4,8,10-11H,1,5-7H2,2-3H3
InChIKeyKSZGCZAYAQCLGJ-UHFFFAOYSA-N
XLogP0.90
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2,2-Diallylpiperazine
CID 686590
2,2-Diallylpiperazine dihydrochloride
CID 2892821
2-[(E)-hex-2-enyl]piperazine
CID 18958795
1,1,2,2-Tetrakis(prop-2-enyl)piperazin-1-ium
CID 19604703
2,5,5-Trimethyl-1-prop-2-enylpiperazine
CID 20612347
1-Hept-6-en-3-ylpiperazine
CID 22375101
1-Ethyl-2-prop-2-enylpiperazine
CID 22918265
1-Methyl-2-prop-2-enylpiperazine
CID 22918318
1-Methyl-3-prop-2-enylpiperazine
CID 23395683
2-Hex-2-enylpiperazine
CID 53643519
2-But-2-enylpiperazine
CID 53797120
2-Prop-2-enylpiperazine
CID 53878595

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-2-prop-2-enylpiperazine?
The IUPAC name of 2,5-dimethyl-2-prop-2-enylpiperazine (CID 91377564) is 2,5-dimethyl-2-prop-2-enylpiperazine.
What is the SMILES notation for 2,5-dimethyl-2-prop-2-enylpiperazine?
The canonical SMILES for 2,5-dimethyl-2-prop-2-enylpiperazine is C=CCC1(C)CNC(C)CN1.
What is the InChIKey of 2,5-dimethyl-2-prop-2-enylpiperazine?
The InChIKey is KSZGCZAYAQCLGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2/c1-4-5-9(3)7-10-8(2)6-11-9/h4,8,10-11H,1,5-7H2,2-3H3.
What are the key properties of 2,5-dimethyl-2-prop-2-enylpiperazine?
2,5-dimethyl-2-prop-2-enylpiperazine has a molecular weight of 154.26 g/mol, XLogP of 0.90, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-2-prop-2-enylpiperazine is sourced from PubChem (CID 91377564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).