5-fluoro-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine

C7H5FN4OS — CID 106928320

IUPAC5-fluoro-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine
SMILESNc1ncc(F)c(Sc2ncco2)n1
InChIInChI=1S/C7H5FN4OS/c8-4-3-11-6(9)12-5(4)14-7-10-1-2-13-7/h1-3H,(H2,9,11,12)
InChIKeyCQHHLCYYQDFGFI-UHFFFAOYSA-N
MW212.21 g/mol
LogP1.34
Rot. Bonds2

About 5-fluoro-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine

5-fluoro-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine (PubChem CID 106928320) has the molecular formula C7H5FN4OS and a molecular weight of 212.21 g/mol. Its IUPAC name is 5-fluoro-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine.

Molecular Properties

Compound Name5-fluoro-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine
PubChem CID106928320
Molecular FormulaC7H5FN4OS
Molecular Weight212.21 g/mol
Exact Mass212.02
IUPAC Name5-fluoro-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine
SMILESNc1ncc(F)c(Sc2ncco2)n1
InChIInChI=1S/C7H5FN4OS/c8-4-3-11-6(9)12-5(4)14-7-10-1-2-13-7/h1-3H,(H2,9,11,12)
InChIKeyCQHHLCYYQDFGFI-UHFFFAOYSA-N
XLogP1.34
TPSA77.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.21
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[6-Chloro-2-(trifluoromethyl)pyrimidin-4-yl]sulfanyl-1,3-oxazole
CID 106923333
2-(6-Fluoropyrimidin-4-yl)sulfanyl-1,3-oxazole
CID 106923340
2-(2-Chloro-5-fluoropyrimidin-4-yl)sulfanyl-1,3-oxazole
CID 106923407
2-(2-Chloro-5-fluoropyrimidin-4-yl)sulfanyl-4-methyl-1,3-oxazole
CID 106923484
4-(1,3-Oxazol-2-ylsulfanyl)-6-(trifluoromethyl)pyrimidin-2-amine
CID 106928204
N-methyl-6-(1,3-oxazol-2-ylsulfanyl)-2-(trifluoromethyl)pyrimidin-4-amine
CID 106928238
5-fluoro-N-methyl-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine
CID 106928252
5-fluoro-4-(1,3-oxazol-2-ylsulfanyl)-N-propylpyrimidin-2-amine
CID 106928253
6-(1,3-Oxazol-2-ylsulfanyl)-2-(trifluoromethyl)pyrimidin-4-amine
CID 106928260
6-(1,3-oxazol-2-ylsulfanyl)-N-propyl-2-(trifluoromethyl)pyrimidin-4-amine
CID 106928261
N-ethyl-5-fluoro-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine
CID 106928349
N-ethyl-6-(1,3-oxazol-2-ylsulfanyl)-2-(trifluoromethyl)pyrimidin-4-amine
CID 106928386

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine?
The IUPAC name of 5-fluoro-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine (CID 106928320) is 5-fluoro-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine.
What is the SMILES notation for 5-fluoro-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine?
The canonical SMILES for 5-fluoro-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine is Nc1ncc(F)c(Sc2ncco2)n1.
What is the InChIKey of 5-fluoro-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine?
The InChIKey is CQHHLCYYQDFGFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5FN4OS/c8-4-3-11-6(9)12-5(4)14-7-10-1-2-13-7/h1-3H,(H2,9,11,12).
What are the key properties of 5-fluoro-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine?
5-fluoro-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine has a molecular weight of 212.21 g/mol, XLogP of 1.34, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine is sourced from PubChem (CID 106928320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).