3-fluoro-6-pyrazin-2-ylpyridine-2-carbaldehyde

C10H6FN3O — CID 59201289

IUPAC3-fluoro-6-pyrazin-2-ylpyridine-2-carbaldehyde
SMILESO=Cc1nc(-c2cnccn2)ccc1F
InChIInChI=1S/C10H6FN3O/c11-7-1-2-8(14-10(7)6-15)9-5-12-3-4-13-9/h1-6H
InChIKeyORWCCBANVMRFMX-UHFFFAOYSA-N
MW203.18 g/mol
LogP1.49
Rot. Bonds2

About 3-fluoro-6-pyrazin-2-ylpyridine-2-carbaldehyde

3-fluoro-6-pyrazin-2-ylpyridine-2-carbaldehyde (PubChem CID 59201289) has the molecular formula C10H6FN3O and a molecular weight of 203.18 g/mol. Its IUPAC name is 3-fluoro-6-pyrazin-2-ylpyridine-2-carbaldehyde.

Molecular Properties

Compound Name3-fluoro-6-pyrazin-2-ylpyridine-2-carbaldehyde
PubChem CID59201289
Molecular FormulaC10H6FN3O
Molecular Weight203.18 g/mol
Exact Mass203.05
IUPAC Name3-fluoro-6-pyrazin-2-ylpyridine-2-carbaldehyde
SMILESO=Cc1nc(-c2cnccn2)ccc1F
InChIInChI=1S/C10H6FN3O/c11-7-1-2-8(14-10(7)6-15)9-5-12-3-4-13-9/h1-6H
InChIKeyORWCCBANVMRFMX-UHFFFAOYSA-N
XLogP1.49
TPSA55.74 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.18
LogP ≤ 51.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-6-pyrazin-2-ylpyridine-2-carbaldehyde?
The IUPAC name of 3-fluoro-6-pyrazin-2-ylpyridine-2-carbaldehyde (CID 59201289) is 3-fluoro-6-pyrazin-2-ylpyridine-2-carbaldehyde.
What is the SMILES notation for 3-fluoro-6-pyrazin-2-ylpyridine-2-carbaldehyde?
The canonical SMILES for 3-fluoro-6-pyrazin-2-ylpyridine-2-carbaldehyde is O=Cc1nc(-c2cnccn2)ccc1F.
What is the InChIKey of 3-fluoro-6-pyrazin-2-ylpyridine-2-carbaldehyde?
The InChIKey is ORWCCBANVMRFMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6FN3O/c11-7-1-2-8(14-10(7)6-15)9-5-12-3-4-13-9/h1-6H.
What are the key properties of 3-fluoro-6-pyrazin-2-ylpyridine-2-carbaldehyde?
3-fluoro-6-pyrazin-2-ylpyridine-2-carbaldehyde has a molecular weight of 203.18 g/mol, XLogP of 1.49, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-6-pyrazin-2-ylpyridine-2-carbaldehyde is sourced from PubChem (CID 59201289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).