6-fluoro-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazin-2-amine

C9H10FN5 — CID 164646869

IUPAC6-fluoro-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazin-2-amine
SMILESFc1cncc(NCCc2cn[nH]c2)n1
InChIInChI=1S/C9H10FN5/c10-8-5-11-6-9(15-8)12-2-1-7-3-13-14-4-7/h3-6H,1-2H2,(H,12,15)(H,13,14)
InChIKeyAVFJLWDVJFOVQL-UHFFFAOYSA-N
MW207.21 g/mol
LogP0.99
Rot. Bonds4

About 6-fluoro-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazin-2-amine

6-fluoro-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazin-2-amine (PubChem CID 164646869) has the molecular formula C9H10FN5 and a molecular weight of 207.21 g/mol. Its IUPAC name is 6-fluoro-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazin-2-amine.

Molecular Properties

Compound Name6-fluoro-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazin-2-amine
PubChem CID164646869
Molecular FormulaC9H10FN5
Molecular Weight207.21 g/mol
Exact Mass207.09
IUPAC Name6-fluoro-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazin-2-amine
SMILESFc1cncc(NCCc2cn[nH]c2)n1
InChIInChI=1S/C9H10FN5/c10-8-5-11-6-9(15-8)12-2-1-7-3-13-14-4-7/h3-6H,1-2H2,(H,12,15)(H,13,14)
InChIKeyAVFJLWDVJFOVQL-UHFFFAOYSA-N
XLogP0.99
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.21
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazin-2-amine?
The IUPAC name of 6-fluoro-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazin-2-amine (CID 164646869) is 6-fluoro-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazin-2-amine.
What is the SMILES notation for 6-fluoro-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazin-2-amine?
The canonical SMILES for 6-fluoro-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazin-2-amine is Fc1cncc(NCCc2cn[nH]c2)n1.
What is the InChIKey of 6-fluoro-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazin-2-amine?
The InChIKey is AVFJLWDVJFOVQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FN5/c10-8-5-11-6-9(15-8)12-2-1-7-3-13-14-4-7/h3-6H,1-2H2,(H,12,15)(H,13,14).
What are the key properties of 6-fluoro-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazin-2-amine?
6-fluoro-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazin-2-amine has a molecular weight of 207.21 g/mol, XLogP of 0.99, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-[2-(1H-pyrazol-4-yl)ethyl]pyrazin-2-amine is sourced from PubChem (CID 164646869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).