1-ethyl-2,4-dimethyl-1,2,4-triazolidine

C6H15N3 — CID 123979649

IUPAC1-ethyl-2,4-dimethyl-1,2,4-triazolidine
SMILESCCN1CN(C)CN1C
InChIInChI=1S/C6H15N3/c1-4-9-6-7(2)5-8(9)3/h4-6H2,1-3H3
InChIKeyGACDLSHHRXJWJP-UHFFFAOYSA-N
MW129.21 g/mol
LogP0.02
Rot. Bonds1

About 1-ethyl-2,4-dimethyl-1,2,4-triazolidine

1-ethyl-2,4-dimethyl-1,2,4-triazolidine (PubChem CID 123979649) has the molecular formula C6H15N3 and a molecular weight of 129.21 g/mol. Its IUPAC name is 1-ethyl-2,4-dimethyl-1,2,4-triazolidine.

Molecular Properties

Compound Name1-ethyl-2,4-dimethyl-1,2,4-triazolidine
PubChem CID123979649
Molecular FormulaC6H15N3
Molecular Weight129.21 g/mol
Exact Mass129.13
IUPAC Name1-ethyl-2,4-dimethyl-1,2,4-triazolidine
SMILESCCN1CN(C)CN1C
InChIInChI=1S/C6H15N3/c1-4-9-6-7(2)5-8(9)3/h4-6H2,1-3H3
InChIKeyGACDLSHHRXJWJP-UHFFFAOYSA-N
XLogP0.02
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.21
LogP ≤ 50.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-ethyl-2,4-dimethyl-1,2,4-triazolidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,2,4,5-Tetramethyl-1,2,4-triazolidine-3-thione
CID 15001252
Pentamethyltetrazol
CID 129632695
1,2,3,4-Tetramethyl-1,2,4-triazolidine
CID 18338490
1,2,3,4-Tetramethyl-5-methylidene-1,2,4-triazolidine
CID 18717180
CID 57688632
CID 57688632
1,2,3,4,5-Pentamethyl-1,2,4-triazolidine
CID 59881570
CID 59923857
CID 59923857
CID 59923858
CID 59923858
1-Azido-3-methylimidazolidine
CID 151429663
N-ethyl-N,3-dimethylimidazolidin-1-amine
CID 155107085
N,N,3-trimethylimidazolidin-1-amine
CID 155150561
N,N,1,3-tetramethylimidazolidin-1-ium-1-amine chloride
CID 175539256

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2,4-dimethyl-1,2,4-triazolidine?
The IUPAC name of 1-ethyl-2,4-dimethyl-1,2,4-triazolidine (CID 123979649) is 1-ethyl-2,4-dimethyl-1,2,4-triazolidine.
What is the SMILES notation for 1-ethyl-2,4-dimethyl-1,2,4-triazolidine?
The canonical SMILES for 1-ethyl-2,4-dimethyl-1,2,4-triazolidine is CCN1CN(C)CN1C.
What is the InChIKey of 1-ethyl-2,4-dimethyl-1,2,4-triazolidine?
The InChIKey is GACDLSHHRXJWJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15N3/c1-4-9-6-7(2)5-8(9)3/h4-6H2,1-3H3.
What are the key properties of 1-ethyl-2,4-dimethyl-1,2,4-triazolidine?
1-ethyl-2,4-dimethyl-1,2,4-triazolidine has a molecular weight of 129.21 g/mol, XLogP of 0.02, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2,4-dimethyl-1,2,4-triazolidine is sourced from PubChem (CID 123979649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).