1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]propan-2-one

C19H15F3N6O2 — CID 167622689

IUPAC1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]propan-2-one
SMILESCn1nc(CC(=O)COc2ccc(-c3cnc4cnccn34)cn2)cc1C(F)(F)F
InChIInChI=1S/C19H15F3N6O2/c1-27-16(19(20,21)22)7-13(26-27)6-14(29)11-30-18-3-2-12(8-25-18)15-9-24-17-10-23-4-5-28(15)17/h2-5,7-10H,6,11H2,1H3
InChIKeyKXPNJUAREKTLAB-UHFFFAOYSA-N
MW416.36 g/mol
LogP2.73
Rot. Bonds6

About 1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]propan-2-one

1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]propan-2-one (PubChem CID 167622689) has the molecular formula C19H15F3N6O2 and a molecular weight of 416.36 g/mol. Its IUPAC name is 1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]propan-2-one.

Molecular Properties

Compound Name1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]propan-2-one
PubChem CID167622689
Molecular FormulaC19H15F3N6O2
Molecular Weight416.36 g/mol
Exact Mass416.12
IUPAC Name1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]propan-2-one
SMILESCn1nc(CC(=O)COc2ccc(-c3cnc4cnccn34)cn2)cc1C(F)(F)F
InChIInChI=1S/C19H15F3N6O2/c1-27-16(19(20,21)22)7-13(26-27)6-14(29)11-30-18-3-2-12(8-25-18)15-9-24-17-10-23-4-5-28(15)17/h2-5,7-10H,6,11H2,1H3
InChIKeyKXPNJUAREKTLAB-UHFFFAOYSA-N
XLogP2.73
TPSA87.20 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.36
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]propan-2-one 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

N-methyl-5-[7-(1-methylpyrazol-4-yl)-6-phenylmethoxyimidazo[1,2-b]pyridazin-3-yl]pyridine-3-carboxamide
CID 161428819
7-[[2-(6-Methoxy-2-pyridinyl)imidazol-1-yl]methyl]-8-propyl-[1,2,4]triazolo[1,5-c]pyrimidine
CID 11256579
US11247989, Example 156
CID 132186600
2-(Difluoromethyl)-5-[5-fluoro-6-(imidazo[1,2-a]pyridin-8-yloxymethyl)-3-pyridinyl]-1,3,4-oxadiazole
CID 169235861
2-(Difluoromethyl)-5-[6-(imidazo[1,2-a]pyridin-8-yloxymethyl)-3-pyridinyl]-1,3,4-oxadiazole
CID 169290331
3-(6-Methoxy-3-pyridinyl)-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazine
CID 155544098
6-(1-Methylpyrazol-4-yl)-3-[3-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyrazine
CID 155554469
6-(3-Ethoxyphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazine
CID 155563077
2-(Furan-2-yl)-5-pyridin-4-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
CID 2822905
3-(1-Benzylpyrazol-4-yl)-6-(3-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazine
CID 162646728
3-(2-Methylpyrazol-3-yl)-6-(3-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazine
CID 162654937
3-(1-Methylpyrazol-4-yl)-6-(3-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazine
CID 162662356

Frequently Asked Questions

What is the IUPAC name of 1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]propan-2-one?
The IUPAC name of 1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]propan-2-one (CID 167622689) is 1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]propan-2-one.
What is the SMILES notation for 1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]propan-2-one?
The canonical SMILES for 1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]propan-2-one is Cn1nc(CC(=O)COc2ccc(-c3cnc4cnccn34)cn2)cc1C(F)(F)F.
What is the InChIKey of 1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]propan-2-one?
The InChIKey is KXPNJUAREKTLAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15F3N6O2/c1-27-16(19(20,21)22)7-13(26-27)6-14(29)11-30-18-3-2-12(8-25-18)15-9-24-17-10-23-4-5-28(15)17/h2-5,7-10H,6,11H2,1H3.
What are the key properties of 1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]propan-2-one?
1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]propan-2-one has a molecular weight of 416.36 g/mol, XLogP of 2.73, 6 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-imidazo[1,2-a]pyrazin-3-yl-2-pyridinyl)oxy]-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]propan-2-one is sourced from PubChem (CID 167622689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).