4-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazin-2-yl]butanamide

C13H14F3N5O2 — CID 23202603

IUPAC4-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazin-2-yl]butanamide
SMILESCn1nc(C(F)(F)F)cc1Oc1cncc(CCCC(N)=O)n1
InChIInChI=1S/C13H14F3N5O2/c1-21-12(5-9(20-21)13(14,15)16)23-11-7-18-6-8(19-11)3-2-4-10(17)22/h5-7H,2-4H2,1H3,(H2,17,22)
InChIKeyLDLYJZUUQWEGTO-UHFFFAOYSA-N
MW329.28 g/mol
LogP1.83
Rot. Bonds6

About 4-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazin-2-yl]butanamide

4-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazin-2-yl]butanamide (PubChem CID 23202603) has the molecular formula C13H14F3N5O2 and a molecular weight of 329.28 g/mol. Its IUPAC name is 4-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazin-2-yl]butanamide.

Molecular Properties

Compound Name4-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazin-2-yl]butanamide
PubChem CID23202603
Molecular FormulaC13H14F3N5O2
Molecular Weight329.28 g/mol
Exact Mass329.11
IUPAC Name4-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazin-2-yl]butanamide
SMILESCn1nc(C(F)(F)F)cc1Oc1cncc(CCCC(N)=O)n1
InChIInChI=1S/C13H14F3N5O2/c1-21-12(5-9(20-21)13(14,15)16)23-11-7-18-6-8(19-11)3-2-4-10(17)22/h5-7H,2-4H2,1H3,(H2,17,22)
InChIKeyLDLYJZUUQWEGTO-UHFFFAOYSA-N
XLogP1.83
TPSA95.92 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.28
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazin-2-yl]butanamide 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-(4-amino-4-oxobutyl)-4-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazin-2-yl]butanamide
CID 23202607
N-(2-amino-2-oxoethyl)-2-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazin-2-yl]acetamide
CID 23202612
[2-Methyl-1-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazin-2-yl]propan-2-yl] carbamate
CID 23202615
5-[6-[1-Methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazin-2-yl]pentanamide
CID 23202627
2-Cyclopropyl-2-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazin-2-yl]acetamide
CID 54305628
N-ethyl-4-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazin-2-yl]butanamide
CID 67675695
N-butyl-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazine-2-carboxamide
CID 141579975
6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxy-N-propylpyrazine-2-carboxamide
CID 141579989
[3-(2,5-Dimethylpyrazol-3-yl)oxypyrazin-2-yl]methanamine
CID 81341431
[5-(2,5-Dimethylpyrazol-3-yl)oxypyrazin-2-yl]methanamine
CID 81342457
[6-(2,5-Dimethylpyrazol-3-yl)oxypyrazin-2-yl]methanamine
CID 81345766
N-[[6-(2,5-dimethylpyrazol-3-yl)oxypyrazin-2-yl]methyl]ethanamine
CID 81346388

Frequently Asked Questions

What is the IUPAC name of 4-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazin-2-yl]butanamide?
The IUPAC name of 4-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazin-2-yl]butanamide (CID 23202603) is 4-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazin-2-yl]butanamide.
What is the SMILES notation for 4-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazin-2-yl]butanamide?
The canonical SMILES for 4-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazin-2-yl]butanamide is Cn1nc(C(F)(F)F)cc1Oc1cncc(CCCC(N)=O)n1.
What is the InChIKey of 4-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazin-2-yl]butanamide?
The InChIKey is LDLYJZUUQWEGTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14F3N5O2/c1-21-12(5-9(20-21)13(14,15)16)23-11-7-18-6-8(19-11)3-2-4-10(17)22/h5-7H,2-4H2,1H3,(H2,17,22).
What are the key properties of 4-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazin-2-yl]butanamide?
4-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazin-2-yl]butanamide has a molecular weight of 329.28 g/mol, XLogP of 1.83, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazin-2-yl]butanamide is sourced from PubChem (CID 23202603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).