3-(2-fluoroethyl)-1-pyridin-3-ylpyrazol-4-amine

C10H11FN4 — CID 174747041

IUPAC3-(2-fluoroethyl)-1-pyridin-3-ylpyrazol-4-amine
SMILESNc1cn(-c2cccnc2)nc1CCF
InChIInChI=1S/C10H11FN4/c11-4-3-10-9(12)7-15(14-10)8-2-1-5-13-6-8/h1-2,5-7H,3-4,12H2
InChIKeyXOJPOIHHJSWRQM-UHFFFAOYSA-N
MW206.22 g/mol
LogP1.36
Rot. Bonds3

About 3-(2-fluoroethyl)-1-pyridin-3-ylpyrazol-4-amine

3-(2-fluoroethyl)-1-pyridin-3-ylpyrazol-4-amine (PubChem CID 174747041) has the molecular formula C10H11FN4 and a molecular weight of 206.22 g/mol. Its IUPAC name is 3-(2-fluoroethyl)-1-pyridin-3-ylpyrazol-4-amine.

Molecular Properties

Compound Name3-(2-fluoroethyl)-1-pyridin-3-ylpyrazol-4-amine
PubChem CID174747041
Molecular FormulaC10H11FN4
Molecular Weight206.22 g/mol
Exact Mass206.10
IUPAC Name3-(2-fluoroethyl)-1-pyridin-3-ylpyrazol-4-amine
SMILESNc1cn(-c2cccnc2)nc1CCF
InChIInChI=1S/C10H11FN4/c11-4-3-10-9(12)7-15(14-10)8-2-1-5-13-6-8/h1-2,5-7H,3-4,12H2
InChIKeyXOJPOIHHJSWRQM-UHFFFAOYSA-N
XLogP1.36
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.22
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(2-fluoroethyl)-1-pyridin-3-ylpyrazol-4-amine?
The IUPAC name of 3-(2-fluoroethyl)-1-pyridin-3-ylpyrazol-4-amine (CID 174747041) is 3-(2-fluoroethyl)-1-pyridin-3-ylpyrazol-4-amine.
What is the SMILES notation for 3-(2-fluoroethyl)-1-pyridin-3-ylpyrazol-4-amine?
The canonical SMILES for 3-(2-fluoroethyl)-1-pyridin-3-ylpyrazol-4-amine is Nc1cn(-c2cccnc2)nc1CCF.
What is the InChIKey of 3-(2-fluoroethyl)-1-pyridin-3-ylpyrazol-4-amine?
The InChIKey is XOJPOIHHJSWRQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FN4/c11-4-3-10-9(12)7-15(14-10)8-2-1-5-13-6-8/h1-2,5-7H,3-4,12H2.
What are the key properties of 3-(2-fluoroethyl)-1-pyridin-3-ylpyrazol-4-amine?
3-(2-fluoroethyl)-1-pyridin-3-ylpyrazol-4-amine has a molecular weight of 206.22 g/mol, XLogP of 1.36, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluoroethyl)-1-pyridin-3-ylpyrazol-4-amine is sourced from PubChem (CID 174747041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).