1-(2-fluoroethyl)-4-methylpyrazol-3-amine

C6H10FN3 — CID 80695188

IUPAC1-(2-fluoroethyl)-4-methylpyrazol-3-amine
SMILESCc1cn(CCF)nc1N
InChIInChI=1S/C6H10FN3/c1-5-4-10(3-2-7)9-6(5)8/h4H,2-3H2,1H3,(H2,8,9)
InChIKeyUNBUODBNPJQNCT-UHFFFAOYSA-N
MW143.16 g/mol
LogP0.74
Rot. Bonds2

About 1-(2-fluoroethyl)-4-methylpyrazol-3-amine

1-(2-fluoroethyl)-4-methylpyrazol-3-amine (PubChem CID 80695188) has the molecular formula C6H10FN3 and a molecular weight of 143.16 g/mol. Its IUPAC name is 1-(2-fluoroethyl)-4-methylpyrazol-3-amine.

Molecular Properties

Compound Name1-(2-fluoroethyl)-4-methylpyrazol-3-amine
PubChem CID80695188
Molecular FormulaC6H10FN3
Molecular Weight143.16 g/mol
Exact Mass143.09
IUPAC Name1-(2-fluoroethyl)-4-methylpyrazol-3-amine
SMILESCc1cn(CCF)nc1N
InChIInChI=1S/C6H10FN3/c1-5-4-10(3-2-7)9-6(5)8/h4H,2-3H2,1H3,(H2,8,9)
InChIKeyUNBUODBNPJQNCT-UHFFFAOYSA-N
XLogP0.74
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.16
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoroethyl)-4-methylpyrazol-3-amine?
The IUPAC name of 1-(2-fluoroethyl)-4-methylpyrazol-3-amine (CID 80695188) is 1-(2-fluoroethyl)-4-methylpyrazol-3-amine.
What is the SMILES notation for 1-(2-fluoroethyl)-4-methylpyrazol-3-amine?
The canonical SMILES for 1-(2-fluoroethyl)-4-methylpyrazol-3-amine is Cc1cn(CCF)nc1N.
What is the InChIKey of 1-(2-fluoroethyl)-4-methylpyrazol-3-amine?
The InChIKey is UNBUODBNPJQNCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10FN3/c1-5-4-10(3-2-7)9-6(5)8/h4H,2-3H2,1H3,(H2,8,9).
What are the key properties of 1-(2-fluoroethyl)-4-methylpyrazol-3-amine?
1-(2-fluoroethyl)-4-methylpyrazol-3-amine has a molecular weight of 143.16 g/mol, XLogP of 0.74, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoroethyl)-4-methylpyrazol-3-amine is sourced from PubChem (CID 80695188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).