3-fluoro-N-(furan-3-ylmethyl)pyrazin-2-amine

C9H8FN3O — CID 164648020

IUPAC3-fluoro-N-(furan-3-ylmethyl)pyrazin-2-amine
SMILESFc1nccnc1NCc1ccoc1
InChIInChI=1S/C9H8FN3O/c10-8-9(12-3-2-11-8)13-5-7-1-4-14-6-7/h1-4,6H,5H2,(H,12,13)
InChIKeyJMPQIQDGWYIBLY-UHFFFAOYSA-N
MW193.18 g/mol
LogP1.82
Rot. Bonds3

About 3-fluoro-N-(furan-3-ylmethyl)pyrazin-2-amine

3-fluoro-N-(furan-3-ylmethyl)pyrazin-2-amine (PubChem CID 164648020) has the molecular formula C9H8FN3O and a molecular weight of 193.18 g/mol. Its IUPAC name is 3-fluoro-N-(furan-3-ylmethyl)pyrazin-2-amine.

Molecular Properties

Compound Name3-fluoro-N-(furan-3-ylmethyl)pyrazin-2-amine
PubChem CID164648020
Molecular FormulaC9H8FN3O
Molecular Weight193.18 g/mol
Exact Mass193.07
IUPAC Name3-fluoro-N-(furan-3-ylmethyl)pyrazin-2-amine
SMILESFc1nccnc1NCc1ccoc1
InChIInChI=1S/C9H8FN3O/c10-8-9(12-3-2-11-8)13-5-7-1-4-14-6-7/h1-4,6H,5H2,(H,12,13)
InChIKeyJMPQIQDGWYIBLY-UHFFFAOYSA-N
XLogP1.82
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.18
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-(furan-3-ylmethyl)pyrazin-2-amine?
The IUPAC name of 3-fluoro-N-(furan-3-ylmethyl)pyrazin-2-amine (CID 164648020) is 3-fluoro-N-(furan-3-ylmethyl)pyrazin-2-amine.
What is the SMILES notation for 3-fluoro-N-(furan-3-ylmethyl)pyrazin-2-amine?
The canonical SMILES for 3-fluoro-N-(furan-3-ylmethyl)pyrazin-2-amine is Fc1nccnc1NCc1ccoc1.
What is the InChIKey of 3-fluoro-N-(furan-3-ylmethyl)pyrazin-2-amine?
The InChIKey is JMPQIQDGWYIBLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8FN3O/c10-8-9(12-3-2-11-8)13-5-7-1-4-14-6-7/h1-4,6H,5H2,(H,12,13).
What are the key properties of 3-fluoro-N-(furan-3-ylmethyl)pyrazin-2-amine?
3-fluoro-N-(furan-3-ylmethyl)pyrazin-2-amine has a molecular weight of 193.18 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-(furan-3-ylmethyl)pyrazin-2-amine is sourced from PubChem (CID 164648020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).