5-heptan-2-yl-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1-carboxamide

C15H23F3N4O — CID 175972274

IUPAC5-heptan-2-yl-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1-carboxamide
SMILESCCCCCC(C)C1CNCc2c(C(N)=O)nc(C(F)(F)F)n21
InChIInChI=1S/C15H23F3N4O/c1-3-4-5-6-9(2)10-7-20-8-11-12(13(19)23)21-14(22(10)11)15(16,17)18/h9-10,20H,3-8H2,1-2H3,(H2,19,23)
InChIKeyKURCJKWCSURDLM-UHFFFAOYSA-N
MW332.37 g/mol
LogP2.86
Rot. Bonds6

About 5-heptan-2-yl-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1-carboxamide

5-heptan-2-yl-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1-carboxamide (PubChem CID 175972274) has the molecular formula C15H23F3N4O and a molecular weight of 332.37 g/mol. Its IUPAC name is 5-heptan-2-yl-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1-carboxamide.

Molecular Properties

Compound Name5-heptan-2-yl-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1-carboxamide
PubChem CID175972274
Molecular FormulaC15H23F3N4O
Molecular Weight332.37 g/mol
Exact Mass332.18
IUPAC Name5-heptan-2-yl-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1-carboxamide
SMILESCCCCCC(C)C1CNCc2c(C(N)=O)nc(C(F)(F)F)n21
InChIInChI=1S/C15H23F3N4O/c1-3-4-5-6-9(2)10-7-20-8-11-12(13(19)23)21-14(22(10)11)15(16,17)18/h9-10,20H,3-8H2,1-2H3,(H2,19,23)
InChIKeyKURCJKWCSURDLM-UHFFFAOYSA-N
XLogP2.86
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.37
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 5-heptan-2-yl-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Imidazo(1,2-a)pyridine-2,3-dicarboxamide, 5,6,7,8-tetrahydro-N,N'-diethyl-7-methyl-
CID 218310
2,5-dimethyl-1-(1-methylpiperidin-4-yl)-N-propylimidazole-4-carboxamide
CID 53181518
N-Isopropyl-2,5-dimethyl-1-(1-methyl-4-piperidinyl)-1H-imidazole-4-carboxamide
CID 53181520
2,5-Dimethyl-N-[3-(4-methylpiperidin-1-YL)propyl]-1-(1-methylpiperidin-4-YL)-1H-imidazole-4-carboxamide
CID 53181565
"N-[2-(1-isopropyl-4-piperidyl)ethyl]-2,5-dimethyl-1-(1-methyl-4-piperidyl)-1H-imidazole-4-carboxamide"
CID 53181593
3-(4,4-difluorocyclohexyl)-N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-8-methyl-5,6,7,9-tetrahydroimidazo[1,5-a][1,4]diazepine-1-carboxamide
CID 57635407
3-(4,4-difluorocyclohexyl)-N-[3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-8-methyl-5,6,7,9-tetrahydroimidazo[1,5-a][1,4]diazepine-1-carboxamide
CID 66931968
Imidazo[1,5-a]pyrazine-1-carboxamide,n-ethyl-5,6,7,8-tetrahydro-3-(trifluoromethyl)-
CID 68011884
Imidazo[1,5-a]pyrazine-1-carboxamide,5,6,7,8-tetrahydro-n-methyl-3-(trifluoromethyl)-
CID 68011887
Imidazo[1,5-a]pyrazine-1-carboxamide,5,6,7,8-tetrahydro-3-(trifluoromethyl)-
CID 68011891
Imidazo[1,5-a]pyrazine-1-carboxamide,5,6,7,8-tetrahydro-n,n-dimethyl-3-(trifluoromethyl)-
CID 68011897
N-(2-methylbutyl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1-carboxamide
CID 68011900

Frequently Asked Questions

What is the IUPAC name of 5-heptan-2-yl-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1-carboxamide?
The IUPAC name of 5-heptan-2-yl-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1-carboxamide (CID 175972274) is 5-heptan-2-yl-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1-carboxamide.
What is the SMILES notation for 5-heptan-2-yl-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1-carboxamide?
The canonical SMILES for 5-heptan-2-yl-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1-carboxamide is CCCCCC(C)C1CNCc2c(C(N)=O)nc(C(F)(F)F)n21.
What is the InChIKey of 5-heptan-2-yl-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1-carboxamide?
The InChIKey is KURCJKWCSURDLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23F3N4O/c1-3-4-5-6-9(2)10-7-20-8-11-12(13(19)23)21-14(22(10)11)15(16,17)18/h9-10,20H,3-8H2,1-2H3,(H2,19,23).
What are the key properties of 5-heptan-2-yl-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1-carboxamide?
5-heptan-2-yl-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1-carboxamide has a molecular weight of 332.37 g/mol, XLogP of 2.86, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-heptan-2-yl-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1-carboxamide is sourced from PubChem (CID 175972274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).