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

C9H10FN5 — CID 129105061

IUPAC1-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanamine
SMILESCC(N)c1cnc(-n2cc(F)cn2)cn1
InChIInChI=1S/C9H10FN5/c1-6(11)8-3-13-9(4-12-8)15-5-7(10)2-14-15/h2-6H,11H2,1H3
InChIKeyXFJRDDYDWNTDCW-UHFFFAOYSA-N
MW207.21 g/mol
LogP0.82
Rot. Bonds2

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

1-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanamine (PubChem CID 129105061) has the molecular formula C9H10FN5 and a molecular weight of 207.21 g/mol. Its IUPAC name is 1-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanamine.

Molecular Properties

Compound Name1-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanamine
PubChem CID129105061
Molecular FormulaC9H10FN5
Molecular Weight207.21 g/mol
Exact Mass207.09
IUPAC Name1-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanamine
SMILESCC(N)c1cnc(-n2cc(F)cn2)cn1
InChIInChI=1S/C9H10FN5/c1-6(11)8-3-13-9(4-12-8)15-5-7(10)2-14-15/h2-6H,11H2,1H3
InChIKeyXFJRDDYDWNTDCW-UHFFFAOYSA-N
XLogP0.82
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.21
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanamine?
The IUPAC name of 1-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanamine (CID 129105061) is 1-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanamine.
What is the SMILES notation for 1-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanamine?
The canonical SMILES for 1-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanamine is CC(N)c1cnc(-n2cc(F)cn2)cn1.
What is the InChIKey of 1-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanamine?
The InChIKey is XFJRDDYDWNTDCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FN5/c1-6(11)8-3-13-9(4-12-8)15-5-7(10)2-14-15/h2-6H,11H2,1H3.
What are the key properties of 1-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanamine?
1-[5-(4-fluoropyrazol-1-yl)pyrazin-2-yl]ethanamine has a molecular weight of 207.21 g/mol, XLogP of 0.82, 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]ethanamine is sourced from PubChem (CID 129105061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).