1-(2-fluoroethyl)pyrazol-3-amine

C5H8FN3 — CID 80697859

IUPAC1-(2-fluoroethyl)pyrazol-3-amine
SMILESNc1ccn(CCF)n1
InChIInChI=1S/C5H8FN3/c6-2-4-9-3-1-5(7)8-9/h1,3H,2,4H2,(H2,7,8)
InChIKeyMWSMIKDDSZIQEU-UHFFFAOYSA-N
MW129.14 g/mol
LogP0.43
Rot. Bonds2

About 1-(2-fluoroethyl)pyrazol-3-amine

1-(2-fluoroethyl)pyrazol-3-amine (PubChem CID 80697859) has the molecular formula C5H8FN3 and a molecular weight of 129.14 g/mol. Its IUPAC name is 1-(2-fluoroethyl)pyrazol-3-amine.

Molecular Properties

Compound Name1-(2-fluoroethyl)pyrazol-3-amine
PubChem CID80697859
Molecular FormulaC5H8FN3
Molecular Weight129.14 g/mol
Exact Mass129.07
IUPAC Name1-(2-fluoroethyl)pyrazol-3-amine
SMILESNc1ccn(CCF)n1
InChIInChI=1S/C5H8FN3/c6-2-4-9-3-1-5(7)8-9/h1,3H,2,4H2,(H2,7,8)
InChIKeyMWSMIKDDSZIQEU-UHFFFAOYSA-N
XLogP0.43
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.14
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoroethyl)pyrazol-3-amine?
The IUPAC name of 1-(2-fluoroethyl)pyrazol-3-amine (CID 80697859) is 1-(2-fluoroethyl)pyrazol-3-amine.
What is the SMILES notation for 1-(2-fluoroethyl)pyrazol-3-amine?
The canonical SMILES for 1-(2-fluoroethyl)pyrazol-3-amine is Nc1ccn(CCF)n1.
What is the InChIKey of 1-(2-fluoroethyl)pyrazol-3-amine?
The InChIKey is MWSMIKDDSZIQEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8FN3/c6-2-4-9-3-1-5(7)8-9/h1,3H,2,4H2,(H2,7,8).
What are the key properties of 1-(2-fluoroethyl)pyrazol-3-amine?
1-(2-fluoroethyl)pyrazol-3-amine has a molecular weight of 129.14 g/mol, XLogP of 0.43, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoroethyl)pyrazol-3-amine is sourced from PubChem (CID 80697859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).