5-[2-(difluoromethoxy)phenyl]-1H-pyrazole

C10H8F2N2O — CID 22660758

IUPAC5-[2-(difluoromethoxy)phenyl]-1H-pyrazole
SMILESFC(F)Oc1ccccc1-c1ccn[nH]1
InChIInChI=1S/C10H8F2N2O/c11-10(12)15-9-4-2-1-3-7(9)8-5-6-13-14-8/h1-6,10H,(H,13,14)
InChIKeyZVSIHONRYKVQAD-UHFFFAOYSA-N
MW210.18 g/mol
LogP2.68
Rot. Bonds3

About 5-[2-(difluoromethoxy)phenyl]-1H-pyrazole

5-[2-(difluoromethoxy)phenyl]-1H-pyrazole (PubChem CID 22660758) has the molecular formula C10H8F2N2O and a molecular weight of 210.18 g/mol. Its IUPAC name is 5-[2-(difluoromethoxy)phenyl]-1H-pyrazole.

Molecular Properties

Compound Name5-[2-(difluoromethoxy)phenyl]-1H-pyrazole
PubChem CID22660758
Molecular FormulaC10H8F2N2O
Molecular Weight210.18 g/mol
Exact Mass210.06
IUPAC Name5-[2-(difluoromethoxy)phenyl]-1H-pyrazole
SMILESFC(F)Oc1ccccc1-c1ccn[nH]1
InChIInChI=1S/C10H8F2N2O/c11-10(12)15-9-4-2-1-3-7(9)8-5-6-13-14-8/h1-6,10H,(H,13,14)
InChIKeyZVSIHONRYKVQAD-UHFFFAOYSA-N
XLogP2.68
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.18
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(2-Methoxyphenyl)-1H-1,2,3-triazole
CID 9877511
o-(1H-pyrazol-3-yl)phenol
CID 819511
5-(4-phenoxyphenyl)-1H-pyrazole
CID 2806138
4-Fluoro-2-(1H-pyrazol-3-yl)phenol
CID 5068606
3-(2-methoxyphenyl)-1H-pyrazol-5-amine
CID 3240675
3-(4-(4-Fluorophenoxy)phenyl)-1H-pyrazole
CID 9816478
4-(4-methoxyphenyl)-3-methyl-1H-pyrazole
CID 2805464
5-[4-(4-methoxyphenoxy)phenyl]-1H-pyrazole
CID 2806185
4-Methoxy-1H-indazole
CID 24729333
3-(4-Methoxyphenyl)-1H-Pyrazole
CID 599984
3-(4-Methoxyphenyl)-5-(trifluoromethyl)-1H-pyrazole
CID 745487
3-(3-Methoxyphenyl)-1H-Pyrazole
CID 2736766

Frequently Asked Questions

What is the IUPAC name of 5-[2-(difluoromethoxy)phenyl]-1H-pyrazole?
The IUPAC name of 5-[2-(difluoromethoxy)phenyl]-1H-pyrazole (CID 22660758) is 5-[2-(difluoromethoxy)phenyl]-1H-pyrazole.
What is the SMILES notation for 5-[2-(difluoromethoxy)phenyl]-1H-pyrazole?
The canonical SMILES for 5-[2-(difluoromethoxy)phenyl]-1H-pyrazole is FC(F)Oc1ccccc1-c1ccn[nH]1.
What is the InChIKey of 5-[2-(difluoromethoxy)phenyl]-1H-pyrazole?
The InChIKey is ZVSIHONRYKVQAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8F2N2O/c11-10(12)15-9-4-2-1-3-7(9)8-5-6-13-14-8/h1-6,10H,(H,13,14).
What are the key properties of 5-[2-(difluoromethoxy)phenyl]-1H-pyrazole?
5-[2-(difluoromethoxy)phenyl]-1H-pyrazole has a molecular weight of 210.18 g/mol, XLogP of 2.68, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(difluoromethoxy)phenyl]-1H-pyrazole is sourced from PubChem (CID 22660758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).