2-(1-ethylpyrazol-4-yl)oxy-N-methyl-N-(2,2,2-trifluoroethyl)acetamide

C10H14F3N3O2 — CID 99839180

IUPAC2-(1-ethylpyrazol-4-yl)oxy-N-methyl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCCn1cc(OCC(=O)N(C)CC(F)(F)F)cn1
InChIInChI=1S/C10H14F3N3O2/c1-3-16-5-8(4-14-16)18-6-9(17)15(2)7-10(11,12)13/h4-5H,3,6-7H2,1-2H3
InChIKeyHTPSXKDRCFMEEV-UHFFFAOYSA-N
MW265.23 g/mol
LogP1.30
Rot. Bonds5

About 2-(1-ethylpyrazol-4-yl)oxy-N-methyl-N-(2,2,2-trifluoroethyl)acetamide

2-(1-ethylpyrazol-4-yl)oxy-N-methyl-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 99839180) has the molecular formula C10H14F3N3O2 and a molecular weight of 265.23 g/mol. Its IUPAC name is 2-(1-ethylpyrazol-4-yl)oxy-N-methyl-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-(1-ethylpyrazol-4-yl)oxy-N-methyl-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID99839180
Molecular FormulaC10H14F3N3O2
Molecular Weight265.23 g/mol
Exact Mass265.10
IUPAC Name2-(1-ethylpyrazol-4-yl)oxy-N-methyl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCCn1cc(OCC(=O)N(C)CC(F)(F)F)cn1
InChIInChI=1S/C10H14F3N3O2/c1-3-16-5-8(4-14-16)18-6-9(17)15(2)7-10(11,12)13/h4-5H,3,6-7H2,1-2H3
InChIKeyHTPSXKDRCFMEEV-UHFFFAOYSA-N
XLogP1.30
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.23
LogP ≤ 51.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(1-ethylpyrazol-4-yl)oxy-N-methyl-N-(2,2,2-trifluoroethyl)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 2-(1-ethylpyrazol-4-yl)oxy-N-methyl-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-(1-ethylpyrazol-4-yl)oxy-N-methyl-N-(2,2,2-trifluoroethyl)acetamide (CID 99839180) is 2-(1-ethylpyrazol-4-yl)oxy-N-methyl-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-(1-ethylpyrazol-4-yl)oxy-N-methyl-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-(1-ethylpyrazol-4-yl)oxy-N-methyl-N-(2,2,2-trifluoroethyl)acetamide is CCn1cc(OCC(=O)N(C)CC(F)(F)F)cn1.
What is the InChIKey of 2-(1-ethylpyrazol-4-yl)oxy-N-methyl-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is HTPSXKDRCFMEEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F3N3O2/c1-3-16-5-8(4-14-16)18-6-9(17)15(2)7-10(11,12)13/h4-5H,3,6-7H2,1-2H3.
What are the key properties of 2-(1-ethylpyrazol-4-yl)oxy-N-methyl-N-(2,2,2-trifluoroethyl)acetamide?
2-(1-ethylpyrazol-4-yl)oxy-N-methyl-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 265.23 g/mol, XLogP of 1.30, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylpyrazol-4-yl)oxy-N-methyl-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 99839180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).