3-N,3-N,5-N,5-N-tetraethyl-1H-1,2,4-triazole-3,5-diamine

C10H21N5 — CID 18342161

IUPAC3-N,3-N,5-N,5-N-tetraethyl-1H-1,2,4-triazole-3,5-diamine
SMILESCCN(CC)c1n[nH]c(N(CC)CC)n1
InChIInChI=1S/C10H21N5/c1-5-14(6-2)9-11-10(13-12-9)15(7-3)8-4/h5-8H2,1-4H3,(H,11,12,13)
InChIKeyFMKKOQIJNMVIAH-UHFFFAOYSA-N
MW211.31 g/mol
LogP1.50
Rot. Bonds6

About 3-N,3-N,5-N,5-N-tetraethyl-1H-1,2,4-triazole-3,5-diamine

3-N,3-N,5-N,5-N-tetraethyl-1H-1,2,4-triazole-3,5-diamine (PubChem CID 18342161) has the molecular formula C10H21N5 and a molecular weight of 211.31 g/mol. Its IUPAC name is 3-N,3-N,5-N,5-N-tetraethyl-1H-1,2,4-triazole-3,5-diamine.

Molecular Properties

Compound Name3-N,3-N,5-N,5-N-tetraethyl-1H-1,2,4-triazole-3,5-diamine
PubChem CID18342161
Molecular FormulaC10H21N5
Molecular Weight211.31 g/mol
Exact Mass211.18
IUPAC Name3-N,3-N,5-N,5-N-tetraethyl-1H-1,2,4-triazole-3,5-diamine
SMILESCCN(CC)c1n[nH]c(N(CC)CC)n1
InChIInChI=1S/C10H21N5/c1-5-14(6-2)9-11-10(13-12-9)15(7-3)8-4/h5-8H2,1-4H3,(H,11,12,13)
InChIKeyFMKKOQIJNMVIAH-UHFFFAOYSA-N
XLogP1.50
TPSA48.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-N,3-N,5-N,5-N-tetraethyl-1H-1,2,4-triazole-3,5-diamine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-N,3-N,5-N,5-N-tetraethyl-1H-1,2,4-triazole-3,5-diamine?
The IUPAC name of 3-N,3-N,5-N,5-N-tetraethyl-1H-1,2,4-triazole-3,5-diamine (CID 18342161) is 3-N,3-N,5-N,5-N-tetraethyl-1H-1,2,4-triazole-3,5-diamine.
What is the SMILES notation for 3-N,3-N,5-N,5-N-tetraethyl-1H-1,2,4-triazole-3,5-diamine?
The canonical SMILES for 3-N,3-N,5-N,5-N-tetraethyl-1H-1,2,4-triazole-3,5-diamine is CCN(CC)c1n[nH]c(N(CC)CC)n1.
What is the InChIKey of 3-N,3-N,5-N,5-N-tetraethyl-1H-1,2,4-triazole-3,5-diamine?
The InChIKey is FMKKOQIJNMVIAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N5/c1-5-14(6-2)9-11-10(13-12-9)15(7-3)8-4/h5-8H2,1-4H3,(H,11,12,13).
What are the key properties of 3-N,3-N,5-N,5-N-tetraethyl-1H-1,2,4-triazole-3,5-diamine?
3-N,3-N,5-N,5-N-tetraethyl-1H-1,2,4-triazole-3,5-diamine has a molecular weight of 211.31 g/mol, XLogP of 1.50, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N,3-N,5-N,5-N-tetraethyl-1H-1,2,4-triazole-3,5-diamine is sourced from PubChem (CID 18342161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).