1-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanimine

C9H8FN5 — CID 155329735

IUPAC1-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanimine
SMILES[H]/N=C(\C)c1cnc(-n2cc(F)cn2)cn1
InChIInChI=1S/C9H8FN5/c1-6(11)8-3-13-9(4-12-8)15-5-7(10)2-14-15/h2-5,11H,1H3/b11-6+
InChIKeyVSEVFGXLKYYENC-IZZDOVSWSA-N
MW205.20 g/mol
LogP1.19
Rot. Bonds2

About 1-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanimine

1-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanimine (PubChem CID 155329735) has the molecular formula C9H8FN5 and a molecular weight of 205.20 g/mol. Its IUPAC name is 1-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanimine.

Molecular Properties

Compound Name1-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanimine
PubChem CID155329735
Molecular FormulaC9H8FN5
Molecular Weight205.20 g/mol
Exact Mass205.08
IUPAC Name1-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanimine
SMILES[H]/N=C(\C)c1cnc(-n2cc(F)cn2)cn1
InChIInChI=1S/C9H8FN5/c1-6(11)8-3-13-9(4-12-8)15-5-7(10)2-14-15/h2-5,11H,1H3/b11-6+
InChIKeyVSEVFGXLKYYENC-IZZDOVSWSA-N
XLogP1.19
TPSA67.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.20
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 1-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanimine 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-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanimine?
The IUPAC name of 1-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanimine (CID 155329735) is 1-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanimine.
What is the SMILES notation for 1-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanimine?
The canonical SMILES for 1-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanimine is [H]/N=C(\C)c1cnc(-n2cc(F)cn2)cn1.
What is the InChIKey of 1-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanimine?
The InChIKey is VSEVFGXLKYYENC-IZZDOVSWSA-N. The full InChI is InChI=1S/C9H8FN5/c1-6(11)8-3-13-9(4-12-8)15-5-7(10)2-14-15/h2-5,11H,1H3/b11-6+.
What are the key properties of 1-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanimine?
1-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanimine has a molecular weight of 205.20 g/mol, XLogP of 1.19, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanimine is sourced from PubChem (CID 155329735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).