2-fluoropyrimidine;sulfane

C4H5FN2S — CID 174635058

IUPAC2-fluoropyrimidine;sulfane
SMILESFc1ncccn1.S
InChIInChI=1S/C4H3FN2.H2S/c5-4-6-2-1-3-7-4;/h1-3H;1H2
InChIKeyUULVFQKTMHRQMY-UHFFFAOYSA-N
MW132.16 g/mol
LogP0.73
Rot. Bonds

About 2-fluoropyrimidine;sulfane

2-fluoropyrimidine;sulfane (PubChem CID 174635058) has the molecular formula C4H5FN2S and a molecular weight of 132.16 g/mol. Its IUPAC name is 2-fluoropyrimidine;sulfane.

Molecular Properties

Compound Name2-fluoropyrimidine;sulfane
PubChem CID174635058
Molecular FormulaC4H5FN2S
Molecular Weight132.16 g/mol
Exact Mass132.02
IUPAC Name2-fluoropyrimidine;sulfane
SMILESFc1ncccn1.S
InChIInChI=1S/C4H3FN2.H2S/c5-4-6-2-1-3-7-4;/h1-3H;1H2
InChIKeyUULVFQKTMHRQMY-UHFFFAOYSA-N
XLogP0.73
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.16
LogP ≤ 50.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-fluoropyrimidine;sulfane?
The IUPAC name of 2-fluoropyrimidine;sulfane (CID 174635058) is 2-fluoropyrimidine;sulfane.
What is the SMILES notation for 2-fluoropyrimidine;sulfane?
The canonical SMILES for 2-fluoropyrimidine;sulfane is Fc1ncccn1.S.
What is the InChIKey of 2-fluoropyrimidine;sulfane?
The InChIKey is UULVFQKTMHRQMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H3FN2.H2S/c5-4-6-2-1-3-7-4;/h1-3H;1H2.
What are the key properties of 2-fluoropyrimidine;sulfane?
2-fluoropyrimidine;sulfane has a molecular weight of 132.16 g/mol, XLogP of 0.73, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoropyrimidine;sulfane is sourced from PubChem (CID 174635058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).