N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]acetamide

C9H11F3N4O — CID 76848918

IUPACN-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]acetamide
SMILESCC(=O)Nc1nc(C(F)(F)F)n2c1CNCC2
InChIInChI=1S/C9H11F3N4O/c1-5(17)14-7-6-4-13-2-3-16(6)8(15-7)9(10,11)12/h13H,2-4H2,1H3,(H,14,17)
InChIKeyXEHLBEOPTBQSJO-UHFFFAOYSA-N
MW248.21 g/mol
LogP0.96
Rot. Bonds1

About N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]acetamide

N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]acetamide (PubChem CID 76848918) has the molecular formula C9H11F3N4O and a molecular weight of 248.21 g/mol. Its IUPAC name is N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]acetamide.

Molecular Properties

Compound NameN-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]acetamide
PubChem CID76848918
Molecular FormulaC9H11F3N4O
Molecular Weight248.21 g/mol
Exact Mass248.09
IUPAC NameN-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]acetamide
SMILESCC(=O)Nc1nc(C(F)(F)F)n2c1CNCC2
InChIInChI=1S/C9H11F3N4O/c1-5(17)14-7-6-4-13-2-3-16(6)8(15-7)9(10,11)12/h13H,2-4H2,1H3,(H,14,17)
InChIKeyXEHLBEOPTBQSJO-UHFFFAOYSA-N
XLogP0.96
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.21
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]acetamide 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 N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]acetamide?
The IUPAC name of N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]acetamide (CID 76848918) is N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]acetamide.
What is the SMILES notation for N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]acetamide?
The canonical SMILES for N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]acetamide is CC(=O)Nc1nc(C(F)(F)F)n2c1CNCC2.
What is the InChIKey of N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]acetamide?
The InChIKey is XEHLBEOPTBQSJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11F3N4O/c1-5(17)14-7-6-4-13-2-3-16(6)8(15-7)9(10,11)12/h13H,2-4H2,1H3,(H,14,17).
What are the key properties of N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]acetamide?
N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]acetamide has a molecular weight of 248.21 g/mol, XLogP of 0.96, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]acetamide is sourced from PubChem (CID 76848918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).