4-ethenyl-5-(1-fluoroethenyl)-1H-pyrazole

C7H7FN2 — CID 171072380

IUPAC4-ethenyl-5-(1-fluoroethenyl)-1H-pyrazole
SMILESC=Cc1cn[nH]c1C(=C)F
InChIInChI=1S/C7H7FN2/c1-3-6-4-9-10-7(6)5(2)8/h3-4H,1-2H2,(H,9,10)
InChIKeyVDPBQBXAMSTQTQ-UHFFFAOYSA-N
MW138.14 g/mol
LogP1.99
Rot. Bonds2

About 4-ethenyl-5-(1-fluoroethenyl)-1H-pyrazole

4-ethenyl-5-(1-fluoroethenyl)-1H-pyrazole (PubChem CID 171072380) has the molecular formula C7H7FN2 and a molecular weight of 138.14 g/mol. Its IUPAC name is 4-ethenyl-5-(1-fluoroethenyl)-1H-pyrazole.

Molecular Properties

Compound Name4-ethenyl-5-(1-fluoroethenyl)-1H-pyrazole
PubChem CID171072380
Molecular FormulaC7H7FN2
Molecular Weight138.14 g/mol
Exact Mass138.06
IUPAC Name4-ethenyl-5-(1-fluoroethenyl)-1H-pyrazole
SMILESC=Cc1cn[nH]c1C(=C)F
InChIInChI=1S/C7H7FN2/c1-3-6-4-9-10-7(6)5(2)8/h3-4H,1-2H2,(H,9,10)
InChIKeyVDPBQBXAMSTQTQ-UHFFFAOYSA-N
XLogP1.99
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.14
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3,4-dimethyl-1H-pyrazole
CID 137735
4-methyl-3-(trifluoromethyl)-1H-pyrazole
CID 2795925
3-Ethenyl-1H-pyrazole
CID 565051
3,4-Bis(trifluoromethyl)-1H-pyrazole
CID 18006160
3-methyl-4-(trifluoromethyl)-1H-pyrazole
CID 59018939
3-(Difluoromethyl)-4-methyl-1H-pyrazole
CID 50896733
4-(bromomethyl)-3-(trifluoromethyl)-1H-pyrazole
CID 66437045
4-(Aminomethyl)-3-(trifluoromethyl)pyrazole
CID 66439839
4,5-bis(difluoromethyl)-1H-pyrazole
CID 66584178
4-prop-2-enyl-5-(trifluoromethyl)-1H-pyrazole
CID 67634288
4-prop-1-en-2-yl-5-(trifluoromethyl)-1H-pyrazole
CID 69922847
CID 89325564
CID 89325564

Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-5-(1-fluoroethenyl)-1H-pyrazole?
The IUPAC name of 4-ethenyl-5-(1-fluoroethenyl)-1H-pyrazole (CID 171072380) is 4-ethenyl-5-(1-fluoroethenyl)-1H-pyrazole.
What is the SMILES notation for 4-ethenyl-5-(1-fluoroethenyl)-1H-pyrazole?
The canonical SMILES for 4-ethenyl-5-(1-fluoroethenyl)-1H-pyrazole is C=Cc1cn[nH]c1C(=C)F.
What is the InChIKey of 4-ethenyl-5-(1-fluoroethenyl)-1H-pyrazole?
The InChIKey is VDPBQBXAMSTQTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7FN2/c1-3-6-4-9-10-7(6)5(2)8/h3-4H,1-2H2,(H,9,10).
What are the key properties of 4-ethenyl-5-(1-fluoroethenyl)-1H-pyrazole?
4-ethenyl-5-(1-fluoroethenyl)-1H-pyrazole has a molecular weight of 138.14 g/mol, XLogP of 1.99, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-5-(1-fluoroethenyl)-1H-pyrazole is sourced from PubChem (CID 171072380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).