[1-(2-fluoroethyl)pyrazol-4-yl]methanamine

C6H10FN3 — CID 80695799

IUPAC[1-(2-fluoroethyl)pyrazol-4-yl]methanamine
SMILESNCc1cnn(CCF)c1
InChIInChI=1S/C6H10FN3/c7-1-2-10-5-6(3-8)4-9-10/h4-5H,1-3,8H2
InChIKeyWULTURUTIQJKKW-UHFFFAOYSA-N
MW143.16 g/mol
LogP0.31
Rot. Bonds3

About [1-(2-fluoroethyl)pyrazol-4-yl]methanamine

[1-(2-fluoroethyl)pyrazol-4-yl]methanamine (PubChem CID 80695799) has the molecular formula C6H10FN3 and a molecular weight of 143.16 g/mol. Its IUPAC name is [1-(2-fluoroethyl)pyrazol-4-yl]methanamine.

Molecular Properties

Compound Name[1-(2-fluoroethyl)pyrazol-4-yl]methanamine
PubChem CID80695799
Molecular FormulaC6H10FN3
Molecular Weight143.16 g/mol
Exact Mass143.09
IUPAC Name[1-(2-fluoroethyl)pyrazol-4-yl]methanamine
SMILESNCc1cnn(CCF)c1
InChIInChI=1S/C6H10FN3/c7-1-2-10-5-6(3-8)4-9-10/h4-5H,1-3,8H2
InChIKeyWULTURUTIQJKKW-UHFFFAOYSA-N
XLogP0.31
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.16
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-(2-fluoroethyl)pyrazol-4-yl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [1-(2-fluoroethyl)pyrazol-4-yl]methanamine?
The IUPAC name of [1-(2-fluoroethyl)pyrazol-4-yl]methanamine (CID 80695799) is [1-(2-fluoroethyl)pyrazol-4-yl]methanamine.
What is the SMILES notation for [1-(2-fluoroethyl)pyrazol-4-yl]methanamine?
The canonical SMILES for [1-(2-fluoroethyl)pyrazol-4-yl]methanamine is NCc1cnn(CCF)c1.
What is the InChIKey of [1-(2-fluoroethyl)pyrazol-4-yl]methanamine?
The InChIKey is WULTURUTIQJKKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10FN3/c7-1-2-10-5-6(3-8)4-9-10/h4-5H,1-3,8H2.
What are the key properties of [1-(2-fluoroethyl)pyrazol-4-yl]methanamine?
[1-(2-fluoroethyl)pyrazol-4-yl]methanamine has a molecular weight of 143.16 g/mol, XLogP of 0.31, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-fluoroethyl)pyrazol-4-yl]methanamine is sourced from PubChem (CID 80695799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).