1,2,3,4-tetrahydroimidazo[2,1-c][1,2,4]triazine

C5H8N4 — CID 150145288

IUPAC1,2,3,4-tetrahydroimidazo[2,1-c][1,2,4]triazine
SMILESc1cn2c(n1)NNCC2
InChIInChI=1S/C5H8N4/c1-3-9-4-2-7-8-5(9)6-1/h1,3,7H,2,4H2,(H,6,8)
InChIKeyFECUNGWZVBLJBA-UHFFFAOYSA-N
MW124.15 g/mol
LogP-0.19
Rot. Bonds

About 1,2,3,4-tetrahydroimidazo[2,1-c][1,2,4]triazine

1,2,3,4-tetrahydroimidazo[2,1-c][1,2,4]triazine (PubChem CID 150145288) has the molecular formula C5H8N4 and a molecular weight of 124.15 g/mol. Its IUPAC name is 1,2,3,4-tetrahydroimidazo[2,1-c][1,2,4]triazine.

Molecular Properties

Compound Name1,2,3,4-tetrahydroimidazo[2,1-c][1,2,4]triazine
PubChem CID150145288
Molecular FormulaC5H8N4
Molecular Weight124.15 g/mol
Exact Mass124.07
IUPAC Name1,2,3,4-tetrahydroimidazo[2,1-c][1,2,4]triazine
SMILESc1cn2c(n1)NNCC2
InChIInChI=1S/C5H8N4/c1-3-9-4-2-7-8-5(9)6-1/h1,3,7H,2,4H2,(H,6,8)
InChIKeyFECUNGWZVBLJBA-UHFFFAOYSA-N
XLogP-0.19
TPSA41.88 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.15
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1,2,3,4-tetrahydroimidazo[2,1-c][1,2,4]triazine?
The IUPAC name of 1,2,3,4-tetrahydroimidazo[2,1-c][1,2,4]triazine (CID 150145288) is 1,2,3,4-tetrahydroimidazo[2,1-c][1,2,4]triazine.
What is the SMILES notation for 1,2,3,4-tetrahydroimidazo[2,1-c][1,2,4]triazine?
The canonical SMILES for 1,2,3,4-tetrahydroimidazo[2,1-c][1,2,4]triazine is c1cn2c(n1)NNCC2.
What is the InChIKey of 1,2,3,4-tetrahydroimidazo[2,1-c][1,2,4]triazine?
The InChIKey is FECUNGWZVBLJBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N4/c1-3-9-4-2-7-8-5(9)6-1/h1,3,7H,2,4H2,(H,6,8).
What are the key properties of 1,2,3,4-tetrahydroimidazo[2,1-c][1,2,4]triazine?
1,2,3,4-tetrahydroimidazo[2,1-c][1,2,4]triazine has a molecular weight of 124.15 g/mol, XLogP of -0.19, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4-tetrahydroimidazo[2,1-c][1,2,4]triazine is sourced from PubChem (CID 150145288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).