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

C6H10FN3 — CID 144511052

IUPAC3-(1-fluoroethyl)-1-methylpyrazol-4-amine
SMILESCC(F)c1nn(C)cc1N
InChIInChI=1S/C6H10FN3/c1-4(7)6-5(8)3-10(2)9-6/h3-4H,8H2,1-2H3
InChIKeyWVBQGKKJNJLBSS-UHFFFAOYSA-N
MW143.16 g/mol
LogP1.03
Rot. Bonds1

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

3-(1-fluoroethyl)-1-methylpyrazol-4-amine (PubChem CID 144511052) has the molecular formula C6H10FN3 and a molecular weight of 143.16 g/mol. Its IUPAC name is 3-(1-fluoroethyl)-1-methylpyrazol-4-amine.

Molecular Properties

Compound Name3-(1-fluoroethyl)-1-methylpyrazol-4-amine
PubChem CID144511052
Molecular FormulaC6H10FN3
Molecular Weight143.16 g/mol
Exact Mass143.09
IUPAC Name3-(1-fluoroethyl)-1-methylpyrazol-4-amine
SMILESCC(F)c1nn(C)cc1N
InChIInChI=1S/C6H10FN3/c1-4(7)6-5(8)3-10(2)9-6/h3-4H,8H2,1-2H3
InChIKeyWVBQGKKJNJLBSS-UHFFFAOYSA-N
XLogP1.03
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.16
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(1-fluoroethyl)-1-methylpyrazol-4-amine?
The IUPAC name of 3-(1-fluoroethyl)-1-methylpyrazol-4-amine (CID 144511052) is 3-(1-fluoroethyl)-1-methylpyrazol-4-amine.
What is the SMILES notation for 3-(1-fluoroethyl)-1-methylpyrazol-4-amine?
The canonical SMILES for 3-(1-fluoroethyl)-1-methylpyrazol-4-amine is CC(F)c1nn(C)cc1N.
What is the InChIKey of 3-(1-fluoroethyl)-1-methylpyrazol-4-amine?
The InChIKey is WVBQGKKJNJLBSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10FN3/c1-4(7)6-5(8)3-10(2)9-6/h3-4H,8H2,1-2H3.
What are the key properties of 3-(1-fluoroethyl)-1-methylpyrazol-4-amine?
3-(1-fluoroethyl)-1-methylpyrazol-4-amine has a molecular weight of 143.16 g/mol, XLogP of 1.03, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-fluoroethyl)-1-methylpyrazol-4-amine is sourced from PubChem (CID 144511052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).