5-fluoro-6-hydroxy-1-[2-(1,3-thiazol-2-yl)propyl]pyrimidine-2,4-dione

C10H10FN3O3S — CID 114126874

IUPAC5-fluoro-6-hydroxy-1-[2-(1,3-thiazol-2-yl)propyl]pyrimidine-2,4-dione
SMILESCC(Cn1c(O)c(F)c(=O)[nH]c1=O)c1nccs1
InChIInChI=1S/C10H10FN3O3S/c1-5(8-12-2-3-18-8)4-14-9(16)6(11)7(15)13-10(14)17/h2-3,5,16H,4H2,1H3,(H,13,15,17)
InChIKeyYOXBIZSFOMJCFM-UHFFFAOYSA-N
MW271.27 g/mol
LogP0.64
Rot. Bonds3

About 5-fluoro-6-hydroxy-1-[2-(1,3-thiazol-2-yl)propyl]pyrimidine-2,4-dione

5-fluoro-6-hydroxy-1-[2-(1,3-thiazol-2-yl)propyl]pyrimidine-2,4-dione (PubChem CID 114126874) has the molecular formula C10H10FN3O3S and a molecular weight of 271.27 g/mol. Its IUPAC name is 5-fluoro-6-hydroxy-1-[2-(1,3-thiazol-2-yl)propyl]pyrimidine-2,4-dione.

Molecular Properties

Compound Name5-fluoro-6-hydroxy-1-[2-(1,3-thiazol-2-yl)propyl]pyrimidine-2,4-dione
PubChem CID114126874
Molecular FormulaC10H10FN3O3S
Molecular Weight271.27 g/mol
Exact Mass271.04
IUPAC Name5-fluoro-6-hydroxy-1-[2-(1,3-thiazol-2-yl)propyl]pyrimidine-2,4-dione
SMILESCC(Cn1c(O)c(F)c(=O)[nH]c1=O)c1nccs1
InChIInChI=1S/C10H10FN3O3S/c1-5(8-12-2-3-18-8)4-14-9(16)6(11)7(15)13-10(14)17/h2-3,5,16H,4H2,1H3,(H,13,15,17)
InChIKeyYOXBIZSFOMJCFM-UHFFFAOYSA-N
XLogP0.64
TPSA87.98 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.27
LogP ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-chloro-5-fluoro-3-[1-(1,3-thiazol-2-yl)ethyl]-1H-pyrimidine-2,4-dione
CID 104369428
6-chloro-5-fluoro-3-[1-(1,3-thiazol-2-yl)propyl]-1H-pyrimidine-2,4-dione
CID 104369489
6-chloro-5-fluoro-3-(1,3-thiazol-2-ylmethyl)-1H-pyrimidine-2,4-dione
CID 104371749
6-chloro-5-fluoro-3-[2-(1,3-thiazol-2-yl)ethyl]-1H-pyrimidine-2,4-dione
CID 104372487
6-chloro-5-fluoro-3-[2-(1,3-thiazol-2-yl)propyl]-1H-pyrimidine-2,4-dione
CID 105910559
5-Fluoro-6-hydroxy-1-(1,3-thiazol-2-ylmethyl)pyrimidine-2,4-dione
CID 112599897
5-Fluoro-6-hydroxy-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrimidine-2,4-dione
CID 112599965
5-Fluoro-6-hydroxy-1-[2-(1,3-thiazol-2-yl)ethyl]pyrimidine-2,4-dione
CID 112600598
5-Fluoro-6-hydroxy-1-[1-(1,3-thiazol-2-yl)ethyl]pyrimidine-2,4-dione
CID 112600989
5-Fluoro-6-hydroxy-1-[1-(1,3-thiazol-2-yl)propyl]pyrimidine-2,4-dione
CID 112601074
5-Fluoro-6-hydroxy-1-[(5-methyl-1,3-thiazol-2-yl)methyl]pyrimidine-2,4-dione
CID 114126881
5-Fluoro-6-hydroxy-1-[2-(1,3-thiazol-2-yl)propan-2-yl]pyrimidine-2,4-dione
CID 114129505

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-6-hydroxy-1-[2-(1,3-thiazol-2-yl)propyl]pyrimidine-2,4-dione?
The IUPAC name of 5-fluoro-6-hydroxy-1-[2-(1,3-thiazol-2-yl)propyl]pyrimidine-2,4-dione (CID 114126874) is 5-fluoro-6-hydroxy-1-[2-(1,3-thiazol-2-yl)propyl]pyrimidine-2,4-dione.
What is the SMILES notation for 5-fluoro-6-hydroxy-1-[2-(1,3-thiazol-2-yl)propyl]pyrimidine-2,4-dione?
The canonical SMILES for 5-fluoro-6-hydroxy-1-[2-(1,3-thiazol-2-yl)propyl]pyrimidine-2,4-dione is CC(Cn1c(O)c(F)c(=O)[nH]c1=O)c1nccs1.
What is the InChIKey of 5-fluoro-6-hydroxy-1-[2-(1,3-thiazol-2-yl)propyl]pyrimidine-2,4-dione?
The InChIKey is YOXBIZSFOMJCFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN3O3S/c1-5(8-12-2-3-18-8)4-14-9(16)6(11)7(15)13-10(14)17/h2-3,5,16H,4H2,1H3,(H,13,15,17).
What are the key properties of 5-fluoro-6-hydroxy-1-[2-(1,3-thiazol-2-yl)propyl]pyrimidine-2,4-dione?
5-fluoro-6-hydroxy-1-[2-(1,3-thiazol-2-yl)propyl]pyrimidine-2,4-dione has a molecular weight of 271.27 g/mol, XLogP of 0.64, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-6-hydroxy-1-[2-(1,3-thiazol-2-yl)propyl]pyrimidine-2,4-dione is sourced from PubChem (CID 114126874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).