5-ethyl-4-propyl-1,2,4-triazol-3-amine

C7H14N4 — CID 162404014

IUPAC5-ethyl-4-propyl-1,2,4-triazol-3-amine
SMILESCCCn1c(N)nnc1CC
InChIInChI=1S/C7H14N4/c1-3-5-11-6(4-2)9-10-7(11)8/h3-5H2,1-2H3,(H2,8,10)
InChIKeyQCCXZOYBJJGPFI-UHFFFAOYSA-N
MW154.22 g/mol
LogP0.83
Rot. Bonds3

About 5-ethyl-4-propyl-1,2,4-triazol-3-amine

5-ethyl-4-propyl-1,2,4-triazol-3-amine (PubChem CID 162404014) has the molecular formula C7H14N4 and a molecular weight of 154.22 g/mol. Its IUPAC name is 5-ethyl-4-propyl-1,2,4-triazol-3-amine.

Molecular Properties

Compound Name5-ethyl-4-propyl-1,2,4-triazol-3-amine
PubChem CID162404014
Molecular FormulaC7H14N4
Molecular Weight154.22 g/mol
Exact Mass154.12
IUPAC Name5-ethyl-4-propyl-1,2,4-triazol-3-amine
SMILESCCCn1c(N)nnc1CC
InChIInChI=1S/C7H14N4/c1-3-5-11-6(4-2)9-10-7(11)8/h3-5H2,1-2H3,(H2,8,10)
InChIKeyQCCXZOYBJJGPFI-UHFFFAOYSA-N
XLogP0.83
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.22
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

dimethyl-1H-1,2,4-triazol-3-amine
CID 307976
1,3-dimethyl-1H-1,2,4-triazol-5-amine
CID 307975
dimethyl-4H-1,2,4-triazol-3-amine hydroiodide
CID 12252711
5-Ethyl-1-methyl-1H-1,2,4-triazol-3-amine
CID 12523007
1-Isopropyl-5-methyl-1H-1,2,4-triazol-3-amine
CID 28064235
(dimethyl-4H-1,2,4-triazol-3-yl)methanamine
CID 43524624
1-methyl-3-(propan-2-yl)-1H-1,2,4-triazol-5-amine
CID 50986546
3-methyl-4-propyl-4H-1,2,4-triazole
CID 53870217
4,5-Dimethyl-4H-1,2,4-triazol-3-amine
CID 12252710
3,4,5-Trimethyl-4H-1,2,4-triazole
CID 573470
5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyridin-3-amine
CID 71683342
2-(4-Methyl-4H-1,2,4-triazol-3-yl)ethan-1-amine
CID 16767398

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-propyl-1,2,4-triazol-3-amine?
The IUPAC name of 5-ethyl-4-propyl-1,2,4-triazol-3-amine (CID 162404014) is 5-ethyl-4-propyl-1,2,4-triazol-3-amine.
What is the SMILES notation for 5-ethyl-4-propyl-1,2,4-triazol-3-amine?
The canonical SMILES for 5-ethyl-4-propyl-1,2,4-triazol-3-amine is CCCn1c(N)nnc1CC.
What is the InChIKey of 5-ethyl-4-propyl-1,2,4-triazol-3-amine?
The InChIKey is QCCXZOYBJJGPFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N4/c1-3-5-11-6(4-2)9-10-7(11)8/h3-5H2,1-2H3,(H2,8,10).
What are the key properties of 5-ethyl-4-propyl-1,2,4-triazol-3-amine?
5-ethyl-4-propyl-1,2,4-triazol-3-amine has a molecular weight of 154.22 g/mol, XLogP of 0.83, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-propyl-1,2,4-triazol-3-amine is sourced from PubChem (CID 162404014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).