N-ethyl-1,2,4-triazol-4-amine;molecular hydrogen

C4H10N4 — CID 143427297

IUPACN-ethyl-1,2,4-triazol-4-amine;molecular hydrogen
SMILESCCNn1cnnc1.[H][H]
InChIInChI=1S/C4H8N4.H2/c1-2-7-8-3-5-6-4-8;/h3-4,7H,2H2,1H3;1H
InChIKeyJOKDEUMLBVSMDM-UHFFFAOYSA-N
MW114.15 g/mol
LogP0.09
Rot. Bonds2

About N-ethyl-1,2,4-triazol-4-amine;molecular hydrogen

N-ethyl-1,2,4-triazol-4-amine;molecular hydrogen (PubChem CID 143427297) has the molecular formula C4H10N4 and a molecular weight of 114.15 g/mol. Its IUPAC name is N-ethyl-1,2,4-triazol-4-amine;molecular hydrogen.

Molecular Properties

Compound NameN-ethyl-1,2,4-triazol-4-amine;molecular hydrogen
PubChem CID143427297
Molecular FormulaC4H10N4
Molecular Weight114.15 g/mol
Exact Mass114.09
IUPAC NameN-ethyl-1,2,4-triazol-4-amine;molecular hydrogen
SMILESCCNn1cnnc1.[H][H]
InChIInChI=1S/C4H8N4.H2/c1-2-7-8-3-5-6-4-8;/h3-4,7H,2H2,1H3;1H
InChIKeyJOKDEUMLBVSMDM-UHFFFAOYSA-N
XLogP0.09
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.15
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1,2,4-triazol-4-amine;molecular hydrogen?
The IUPAC name of N-ethyl-1,2,4-triazol-4-amine;molecular hydrogen (CID 143427297) is N-ethyl-1,2,4-triazol-4-amine;molecular hydrogen.
What is the SMILES notation for N-ethyl-1,2,4-triazol-4-amine;molecular hydrogen?
The canonical SMILES for N-ethyl-1,2,4-triazol-4-amine;molecular hydrogen is CCNn1cnnc1.[H][H].
What is the InChIKey of N-ethyl-1,2,4-triazol-4-amine;molecular hydrogen?
The InChIKey is JOKDEUMLBVSMDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N4.H2/c1-2-7-8-3-5-6-4-8;/h3-4,7H,2H2,1H3;1H.
What are the key properties of N-ethyl-1,2,4-triazol-4-amine;molecular hydrogen?
N-ethyl-1,2,4-triazol-4-amine;molecular hydrogen has a molecular weight of 114.15 g/mol, XLogP of 0.09, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1,2,4-triazol-4-amine;molecular hydrogen is sourced from PubChem (CID 143427297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).