ethane;1-(4-ethenyl-2-pyridinyl)piperazine

C13H21N3 — CID 142364779

IUPACethane;1-(4-ethenyl-2-pyridinyl)piperazine
SMILESC=Cc1ccnc(N2CCNCC2)c1.CC
InChIInChI=1S/C11H15N3.C2H6/c1-2-10-3-4-13-11(9-10)14-7-5-12-6-8-14;1-2/h2-4,9,12H,1,5-8H2;1-2H3
InChIKeyMWCARVGWVFPOBC-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.16
Rot. Bonds2

About ethane;1-(4-ethenyl-2-pyridinyl)piperazine

ethane;1-(4-ethenyl-2-pyridinyl)piperazine (PubChem CID 142364779) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is ethane;1-(4-ethenyl-2-pyridinyl)piperazine.

Molecular Properties

Compound Nameethane;1-(4-ethenyl-2-pyridinyl)piperazine
PubChem CID142364779
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Nameethane;1-(4-ethenyl-2-pyridinyl)piperazine
SMILESC=Cc1ccnc(N2CCNCC2)c1.CC
InChIInChI=1S/C11H15N3.C2H6/c1-2-10-3-4-13-11(9-10)14-7-5-12-6-8-14;1-2/h2-4,9,12H,1,5-8H2;1-2H3
InChIKeyMWCARVGWVFPOBC-UHFFFAOYSA-N
XLogP2.16
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;4-piperazin-1-yl-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine;propane
CID 171069989
1-(4-ethynyl-2-pyridinyl)piperazine
CID 131627287
ethane;2-methyl-4-piperazin-1-ylpyrimidine
CID 144746590
1-[4-(4-chlorophenyl)-2-pyridinyl]piperazine
CID 171059987
1-[4-(1H-pyrazol-5-yl)-2-pyridinyl]piperazine
CID 105486911
1-(4-ethenylphenyl)piperazine;methane
CID 159070972
2,4-di(piperazin-1-yl)pyrimidine
CID 6610945
1-(5-ethenyl-3-pyridinyl)piperazine
CID 150234199
N-methyl-4-piperazin-1-ylpyrimidin-2-amine
CID 80838050
2,3-dimethyl-3-[methyl-(2-piperazin-1-yl-4-pyridinyl)boranyl]oxybutan-2-ol
CID 143810157
2,4-diphenyl-6-(2-piperazin-1-yl-4-pyridinyl)pyrimidine
CID 171686343
1-(4-ethenyl-2-pyridinyl)-N,N-dimethylpiperidin-4-amine;N-methyl-6-(3-methylimidazol-4-yl)isoquinolin-3-amine
CID 145392535

Frequently Asked Questions

What is the IUPAC name of ethane;1-(4-ethenyl-2-pyridinyl)piperazine?
The IUPAC name of ethane;1-(4-ethenyl-2-pyridinyl)piperazine (CID 142364779) is ethane;1-(4-ethenyl-2-pyridinyl)piperazine.
What is the SMILES notation for ethane;1-(4-ethenyl-2-pyridinyl)piperazine?
The canonical SMILES for ethane;1-(4-ethenyl-2-pyridinyl)piperazine is C=Cc1ccnc(N2CCNCC2)c1.CC.
What is the InChIKey of ethane;1-(4-ethenyl-2-pyridinyl)piperazine?
The InChIKey is MWCARVGWVFPOBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3.C2H6/c1-2-10-3-4-13-11(9-10)14-7-5-12-6-8-14;1-2/h2-4,9,12H,1,5-8H2;1-2H3.
What are the key properties of ethane;1-(4-ethenyl-2-pyridinyl)piperazine?
ethane;1-(4-ethenyl-2-pyridinyl)piperazine has a molecular weight of 219.33 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-(4-ethenyl-2-pyridinyl)piperazine is sourced from PubChem (CID 142364779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).