5-(2,5-difluorothiophen-3-yl)-1H-pyrazole

C7H4F2N2S — CID 174329640

IUPAC5-(2,5-difluorothiophen-3-yl)-1H-pyrazole
SMILESFc1cc(-c2ccn[nH]2)c(F)s1
InChIInChI=1S/C7H4F2N2S/c8-6-3-4(7(9)12-6)5-1-2-10-11-5/h1-3H,(H,10,11)
InChIKeyHADWGUDGZYJRRC-UHFFFAOYSA-N
MW186.19 g/mol
LogP2.42
Rot. Bonds1

About 5-(2,5-difluorothiophen-3-yl)-1H-pyrazole

5-(2,5-difluorothiophen-3-yl)-1H-pyrazole (PubChem CID 174329640) has the molecular formula C7H4F2N2S and a molecular weight of 186.19 g/mol. Its IUPAC name is 5-(2,5-difluorothiophen-3-yl)-1H-pyrazole.

Molecular Properties

Compound Name5-(2,5-difluorothiophen-3-yl)-1H-pyrazole
PubChem CID174329640
Molecular FormulaC7H4F2N2S
Molecular Weight186.19 g/mol
Exact Mass186.01
IUPAC Name5-(2,5-difluorothiophen-3-yl)-1H-pyrazole
SMILESFc1cc(-c2ccn[nH]2)c(F)s1
InChIInChI=1S/C7H4F2N2S/c8-6-3-4(7(9)12-6)5-1-2-10-11-5/h1-3H,(H,10,11)
InChIKeyHADWGUDGZYJRRC-UHFFFAOYSA-N
XLogP2.42
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.19
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(5-fluoro-2-methylphenyl)-1H-pyrazole
CID 89211129
5-(2-fluoro-3-methylphenyl)-1H-pyrazole
CID 83808322
5-(2,4,5-trichlorophenyl)-1H-pyrazole
CID 155970267
5-(2,3,4,5,6-pentafluorophenyl)-1H-pyrazole;sulfane
CID 159681415
5-[2-(trifluoromethyl)thiophen-3-yl]-1H-pyrazole
CID 174338035
5-[2,4-bis(trifluoromethyl)phenyl]-1H-pyrazole
CID 141155968
1-[4-fluoro-3-(1H-pyrazol-5-yl)phenyl]-N,N-dimethylmethanamine
CID 83410852
5-nitroso-4-(1H-pyrazol-5-yl)thiophene-2-carbaldehyde
CID 129090171
5-methyl-4-(1H-pyrazol-5-yl)-1H-pyrazole
CID 130918479
4-bromo-2-(1H-pyrazol-5-yl)aniline
CID 19772998
5-(5-bromo-2-methylphenyl)-1H-pyrazole
CID 116869080
2-methyl-6-(1H-pyrazol-5-yl)aniline
CID 118989265

Frequently Asked Questions

What is the IUPAC name of 5-(2,5-difluorothiophen-3-yl)-1H-pyrazole?
The IUPAC name of 5-(2,5-difluorothiophen-3-yl)-1H-pyrazole (CID 174329640) is 5-(2,5-difluorothiophen-3-yl)-1H-pyrazole.
What is the SMILES notation for 5-(2,5-difluorothiophen-3-yl)-1H-pyrazole?
The canonical SMILES for 5-(2,5-difluorothiophen-3-yl)-1H-pyrazole is Fc1cc(-c2ccn[nH]2)c(F)s1.
What is the InChIKey of 5-(2,5-difluorothiophen-3-yl)-1H-pyrazole?
The InChIKey is HADWGUDGZYJRRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4F2N2S/c8-6-3-4(7(9)12-6)5-1-2-10-11-5/h1-3H,(H,10,11).
What are the key properties of 5-(2,5-difluorothiophen-3-yl)-1H-pyrazole?
5-(2,5-difluorothiophen-3-yl)-1H-pyrazole has a molecular weight of 186.19 g/mol, XLogP of 2.42, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,5-difluorothiophen-3-yl)-1H-pyrazole is sourced from PubChem (CID 174329640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).