1-(oxolan-2-yl)-4-[2-(trifluoromethoxymethyl)cyclopropyl]pyrazole

C12H15F3N2O2 — CID 175524212

IUPAC1-(oxolan-2-yl)-4-[2-(trifluoromethoxymethyl)cyclopropyl]pyrazole
SMILESFC(F)(F)OCC1CC1c1cnn(C2CCCO2)c1
InChIInChI=1S/C12H15F3N2O2/c13-12(14,15)19-7-8-4-10(8)9-5-16-17(6-9)11-2-1-3-18-11/h5-6,8,10-11H,1-4,7H2
InChIKeyZNRZAPINHULWAG-UHFFFAOYSA-N
MW276.26 g/mol
LogP2.83
Rot. Bonds4

About 1-(oxolan-2-yl)-4-[2-(trifluoromethoxymethyl)cyclopropyl]pyrazole

1-(oxolan-2-yl)-4-[2-(trifluoromethoxymethyl)cyclopropyl]pyrazole (PubChem CID 175524212) has the molecular formula C12H15F3N2O2 and a molecular weight of 276.26 g/mol. Its IUPAC name is 1-(oxolan-2-yl)-4-[2-(trifluoromethoxymethyl)cyclopropyl]pyrazole.

Molecular Properties

Compound Name1-(oxolan-2-yl)-4-[2-(trifluoromethoxymethyl)cyclopropyl]pyrazole
PubChem CID175524212
Molecular FormulaC12H15F3N2O2
Molecular Weight276.26 g/mol
Exact Mass276.11
IUPAC Name1-(oxolan-2-yl)-4-[2-(trifluoromethoxymethyl)cyclopropyl]pyrazole
SMILESFC(F)(F)OCC1CC1c1cnn(C2CCCO2)c1
InChIInChI=1S/C12H15F3N2O2/c13-12(14,15)19-7-8-4-10(8)9-5-16-17(6-9)11-2-1-3-18-11/h5-6,8,10-11H,1-4,7H2
InChIKeyZNRZAPINHULWAG-UHFFFAOYSA-N
XLogP2.83
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.26
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(oxolan-2-yl)-4-[2-(trifluoromethoxymethyl)cyclopropyl]pyrazole?
The IUPAC name of 1-(oxolan-2-yl)-4-[2-(trifluoromethoxymethyl)cyclopropyl]pyrazole (CID 175524212) is 1-(oxolan-2-yl)-4-[2-(trifluoromethoxymethyl)cyclopropyl]pyrazole.
What is the SMILES notation for 1-(oxolan-2-yl)-4-[2-(trifluoromethoxymethyl)cyclopropyl]pyrazole?
The canonical SMILES for 1-(oxolan-2-yl)-4-[2-(trifluoromethoxymethyl)cyclopropyl]pyrazole is FC(F)(F)OCC1CC1c1cnn(C2CCCO2)c1.
What is the InChIKey of 1-(oxolan-2-yl)-4-[2-(trifluoromethoxymethyl)cyclopropyl]pyrazole?
The InChIKey is ZNRZAPINHULWAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F3N2O2/c13-12(14,15)19-7-8-4-10(8)9-5-16-17(6-9)11-2-1-3-18-11/h5-6,8,10-11H,1-4,7H2.
What are the key properties of 1-(oxolan-2-yl)-4-[2-(trifluoromethoxymethyl)cyclopropyl]pyrazole?
1-(oxolan-2-yl)-4-[2-(trifluoromethoxymethyl)cyclopropyl]pyrazole has a molecular weight of 276.26 g/mol, XLogP of 2.83, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxolan-2-yl)-4-[2-(trifluoromethoxymethyl)cyclopropyl]pyrazole is sourced from PubChem (CID 175524212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).