1,2-bis(ethenyl)-4-ethyl-1,2,4-triazolidine

C8H15N3 — CID 163456282

IUPAC1,2-bis(ethenyl)-4-ethyl-1,2,4-triazolidine
SMILESC=CN1CN(CC)CN1C=C
InChIInChI=1S/C8H15N3/c1-4-9-7-10(5-2)11(6-3)8-9/h5-6H,2-4,7-8H2,1H3
InChIKeyQZHHSQRYXSUIDJ-UHFFFAOYSA-N
MW153.23 g/mol
LogP1.04
Rot. Bonds3

About 1,2-bis(ethenyl)-4-ethyl-1,2,4-triazolidine

1,2-bis(ethenyl)-4-ethyl-1,2,4-triazolidine (PubChem CID 163456282) has the molecular formula C8H15N3 and a molecular weight of 153.23 g/mol. Its IUPAC name is 1,2-bis(ethenyl)-4-ethyl-1,2,4-triazolidine.

Molecular Properties

Compound Name1,2-bis(ethenyl)-4-ethyl-1,2,4-triazolidine
PubChem CID163456282
Molecular FormulaC8H15N3
Molecular Weight153.23 g/mol
Exact Mass153.13
IUPAC Name1,2-bis(ethenyl)-4-ethyl-1,2,4-triazolidine
SMILESC=CN1CN(CC)CN1C=C
InChIInChI=1S/C8H15N3/c1-4-9-7-10(5-2)11(6-3)8-9/h5-6H,2-4,7-8H2,1H3
InChIKeyQZHHSQRYXSUIDJ-UHFFFAOYSA-N
XLogP1.04
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 51.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,2-bis(ethenyl)-4-ethyl-1,2,4-triazolidine?
The IUPAC name of 1,2-bis(ethenyl)-4-ethyl-1,2,4-triazolidine (CID 163456282) is 1,2-bis(ethenyl)-4-ethyl-1,2,4-triazolidine.
What is the SMILES notation for 1,2-bis(ethenyl)-4-ethyl-1,2,4-triazolidine?
The canonical SMILES for 1,2-bis(ethenyl)-4-ethyl-1,2,4-triazolidine is C=CN1CN(CC)CN1C=C.
What is the InChIKey of 1,2-bis(ethenyl)-4-ethyl-1,2,4-triazolidine?
The InChIKey is QZHHSQRYXSUIDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3/c1-4-9-7-10(5-2)11(6-3)8-9/h5-6H,2-4,7-8H2,1H3.
What are the key properties of 1,2-bis(ethenyl)-4-ethyl-1,2,4-triazolidine?
1,2-bis(ethenyl)-4-ethyl-1,2,4-triazolidine has a molecular weight of 153.23 g/mol, XLogP of 1.04, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis(ethenyl)-4-ethyl-1,2,4-triazolidine is sourced from PubChem (CID 163456282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).