7-[(4-fluorophenyl)methyl]-2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine;2,2,2-trifluoroacetic acid

C19H19F4N5O2 — CID 118743883

IUPAC7-[(4-fluorophenyl)methyl]-2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine;2,2,2-trifluoroacetic acid
SMILESFc1ccc(CN2CCn3cc(Cn4cccn4)nc3C2)cc1.O=C(O)C(F)(F)F
InChIInChI=1S/C17H18FN5.C2HF3O2/c18-15-4-2-14(3-5-15)10-21-8-9-22-11-16(20-17(22)13-21)12-23-7-1-6-19-23;3-2(4,5)1(6)7/h1-7,11H,8-10,12-13H2;(H,6,7)
InChIKeyYGFZBSGNVOCFMM-UHFFFAOYSA-N
MW425.39 g/mol
LogP2.92
Rot. Bonds4

About 7-[(4-fluorophenyl)methyl]-2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine;2,2,2-trifluoroacetic acid

7-[(4-fluorophenyl)methyl]-2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine;2,2,2-trifluoroacetic acid (PubChem CID 118743883) has the molecular formula C19H19F4N5O2 and a molecular weight of 425.39 g/mol. Its IUPAC name is 7-[(4-fluorophenyl)methyl]-2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine;2,2,2-trifluoroacetic acid.

Molecular Properties

Compound Name7-[(4-fluorophenyl)methyl]-2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine;2,2,2-trifluoroacetic acid
PubChem CID118743883
Molecular FormulaC19H19F4N5O2
Molecular Weight425.39 g/mol
Exact Mass425.15
IUPAC Name7-[(4-fluorophenyl)methyl]-2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine;2,2,2-trifluoroacetic acid
SMILESFc1ccc(CN2CCn3cc(Cn4cccn4)nc3C2)cc1.O=C(O)C(F)(F)F
InChIInChI=1S/C17H18FN5.C2HF3O2/c18-15-4-2-14(3-5-15)10-21-8-9-22-11-16(20-17(22)13-21)12-23-7-1-6-19-23;3-2(4,5)1(6)7/h1-7,11H,8-10,12-13H2;(H,6,7)
InChIKeyYGFZBSGNVOCFMM-UHFFFAOYSA-N
XLogP2.92
TPSA76.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.39
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 7-[(4-fluorophenyl)methyl]-2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine;2,2,2-trifluoroacetic acid 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 7-[(4-fluorophenyl)methyl]-2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine;2,2,2-trifluoroacetic acid?
The IUPAC name of 7-[(4-fluorophenyl)methyl]-2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine;2,2,2-trifluoroacetic acid (CID 118743883) is 7-[(4-fluorophenyl)methyl]-2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine;2,2,2-trifluoroacetic acid.
What is the SMILES notation for 7-[(4-fluorophenyl)methyl]-2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine;2,2,2-trifluoroacetic acid?
The canonical SMILES for 7-[(4-fluorophenyl)methyl]-2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine;2,2,2-trifluoroacetic acid is Fc1ccc(CN2CCn3cc(Cn4cccn4)nc3C2)cc1.O=C(O)C(F)(F)F.
What is the InChIKey of 7-[(4-fluorophenyl)methyl]-2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine;2,2,2-trifluoroacetic acid?
The InChIKey is YGFZBSGNVOCFMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FN5.C2HF3O2/c18-15-4-2-14(3-5-15)10-21-8-9-22-11-16(20-17(22)13-21)12-23-7-1-6-19-23;3-2(4,5)1(6)7/h1-7,11H,8-10,12-13H2;(H,6,7).
What are the key properties of 7-[(4-fluorophenyl)methyl]-2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine;2,2,2-trifluoroacetic acid?
7-[(4-fluorophenyl)methyl]-2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine;2,2,2-trifluoroacetic acid has a molecular weight of 425.39 g/mol, XLogP of 2.92, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(4-fluorophenyl)methyl]-2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine;2,2,2-trifluoroacetic acid is sourced from PubChem (CID 118743883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).