4-(4-aminoimidazo[2,1-f][1,2,4]triazin-7-yl)-2-(hydroxymethyl)-2-methyloxolan-3-ol

C11H15N5O3 — CID 123459392

IUPAC4-(4-aminoimidazo[2,1-f][1,2,4]triazin-7-yl)-2-(hydroxymethyl)-2-methyloxolan-3-ol
SMILESCC1(CO)OCC(c2cnc3c(N)ncnn23)C1O
InChIInChI=1S/C11H15N5O3/c1-11(4-17)8(18)6(3-19-11)7-2-13-10-9(12)14-5-15-16(7)10/h2,5-6,8,17-18H,3-4H2,1H3,(H2,12,14,15)
InChIKeyWNVOPUPJGWFLKA-UHFFFAOYSA-N
MW265.27 g/mol
LogP-1.07
Rot. Bonds2

About 4-(4-aminoimidazo[2,1-f][1,2,4]triazin-7-yl)-2-(hydroxymethyl)-2-methyloxolan-3-ol

4-(4-aminoimidazo[2,1-f][1,2,4]triazin-7-yl)-2-(hydroxymethyl)-2-methyloxolan-3-ol (PubChem CID 123459392) has the molecular formula C11H15N5O3 and a molecular weight of 265.27 g/mol. Its IUPAC name is 4-(4-aminoimidazo[2,1-f][1,2,4]triazin-7-yl)-2-(hydroxymethyl)-2-methyloxolan-3-ol.

Molecular Properties

Compound Name4-(4-aminoimidazo[2,1-f][1,2,4]triazin-7-yl)-2-(hydroxymethyl)-2-methyloxolan-3-ol
PubChem CID123459392
Molecular FormulaC11H15N5O3
Molecular Weight265.27 g/mol
Exact Mass265.12
IUPAC Name4-(4-aminoimidazo[2,1-f][1,2,4]triazin-7-yl)-2-(hydroxymethyl)-2-methyloxolan-3-ol
SMILESCC1(CO)OCC(c2cnc3c(N)ncnn23)C1O
InChIInChI=1S/C11H15N5O3/c1-11(4-17)8(18)6(3-19-11)7-2-13-10-9(12)14-5-15-16(7)10/h2,5-6,8,17-18H,3-4H2,1H3,(H2,12,14,15)
InChIKeyWNVOPUPJGWFLKA-UHFFFAOYSA-N
XLogP-1.07
TPSA118.79 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.27
LogP ≤ 5-1.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Analyze 4-(4-aminoimidazo[2,1-f][1,2,4]triazin-7-yl)-2-(hydroxymethyl)-2-methyloxolan-3-ol 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 4-(4-aminoimidazo[2,1-f][1,2,4]triazin-7-yl)-2-(hydroxymethyl)-2-methyloxolan-3-ol?
The IUPAC name of 4-(4-aminoimidazo[2,1-f][1,2,4]triazin-7-yl)-2-(hydroxymethyl)-2-methyloxolan-3-ol (CID 123459392) is 4-(4-aminoimidazo[2,1-f][1,2,4]triazin-7-yl)-2-(hydroxymethyl)-2-methyloxolan-3-ol.
What is the SMILES notation for 4-(4-aminoimidazo[2,1-f][1,2,4]triazin-7-yl)-2-(hydroxymethyl)-2-methyloxolan-3-ol?
The canonical SMILES for 4-(4-aminoimidazo[2,1-f][1,2,4]triazin-7-yl)-2-(hydroxymethyl)-2-methyloxolan-3-ol is CC1(CO)OCC(c2cnc3c(N)ncnn23)C1O.
What is the InChIKey of 4-(4-aminoimidazo[2,1-f][1,2,4]triazin-7-yl)-2-(hydroxymethyl)-2-methyloxolan-3-ol?
The InChIKey is WNVOPUPJGWFLKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O3/c1-11(4-17)8(18)6(3-19-11)7-2-13-10-9(12)14-5-15-16(7)10/h2,5-6,8,17-18H,3-4H2,1H3,(H2,12,14,15).
What are the key properties of 4-(4-aminoimidazo[2,1-f][1,2,4]triazin-7-yl)-2-(hydroxymethyl)-2-methyloxolan-3-ol?
4-(4-aminoimidazo[2,1-f][1,2,4]triazin-7-yl)-2-(hydroxymethyl)-2-methyloxolan-3-ol has a molecular weight of 265.27 g/mol, XLogP of -1.07, 2 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-aminoimidazo[2,1-f][1,2,4]triazin-7-yl)-2-(hydroxymethyl)-2-methyloxolan-3-ol is sourced from PubChem (CID 123459392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).