1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-5-fluoro-6-hydroxypyrimidine-2,4-dione

C10H10FN3O3S — CID 112599774

IUPAC1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-5-fluoro-6-hydroxypyrimidine-2,4-dione
SMILESCCc1nc(-n2c(O)c(F)c(=O)[nH]c2=O)sc1C
InChIInChI=1S/C10H10FN3O3S/c1-3-5-4(2)18-10(12-5)14-8(16)6(11)7(15)13-9(14)17/h16H,3H2,1-2H3,(H,13,15,17)
InChIKeyFBHWKVDLAHUBTK-UHFFFAOYSA-N
MW271.27 g/mol
LogP0.70
Rot. Bonds2

About 1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-5-fluoro-6-hydroxypyrimidine-2,4-dione

1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-5-fluoro-6-hydroxypyrimidine-2,4-dione (PubChem CID 112599774) has the molecular formula C10H10FN3O3S and a molecular weight of 271.27 g/mol. Its IUPAC name is 1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-5-fluoro-6-hydroxypyrimidine-2,4-dione.

Molecular Properties

Compound Name1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-5-fluoro-6-hydroxypyrimidine-2,4-dione
PubChem CID112599774
Molecular FormulaC10H10FN3O3S
Molecular Weight271.27 g/mol
Exact Mass271.04
IUPAC Name1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-5-fluoro-6-hydroxypyrimidine-2,4-dione
SMILESCCc1nc(-n2c(O)c(F)c(=O)[nH]c2=O)sc1C
InChIInChI=1S/C10H10FN3O3S/c1-3-5-4(2)18-10(12-5)14-8(16)6(11)7(15)13-9(14)17/h16H,3H2,1-2H3,(H,13,15,17)
InChIKeyFBHWKVDLAHUBTK-UHFFFAOYSA-N
XLogP0.70
TPSA87.98 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.27
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-5-fluoro-6-hydroxypyrimidine-2,4-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2,2,2-trifluoroacetamide
CID 62492183
N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2,2-difluoroacetamide
CID 103515645
6-chloro-3-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-5-fluoro-1H-pyrimidine-2,4-dione
CID 104371671
6-chloro-3-(4,5-dimethyl-1,3-thiazol-2-yl)-5-fluoro-1H-pyrimidine-2,4-dione
CID 104372085
5-Fluoro-6-hydroxy-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)pyrimidine-2,4-dione
CID 112600110
1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-5-fluoro-6-hydroxypyrimidine-2,4-dione
CID 112600131
1-(4,5-Dimethyl-1,3-thiazol-2-yl)-5-fluoro-6-hydroxypyrimidine-2,4-dione
CID 112600252
N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)acetamide
CID 21802118
1-(4-Ethyl-5-methyl-1,3-thiazol-2-yl)imidazolidine-2,4,5-trione
CID 61477759
6-chloro-3-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1H-pyrimidine-2,4-dione
CID 104371672
6-chloro-3-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-5-propan-2-yl-1H-pyrimidine-2,4-dione
CID 104371673
6-chloro-3-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-5-propyl-1H-pyrimidine-2,4-dione
CID 104371674

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-5-fluoro-6-hydroxypyrimidine-2,4-dione?
The IUPAC name of 1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-5-fluoro-6-hydroxypyrimidine-2,4-dione (CID 112599774) is 1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-5-fluoro-6-hydroxypyrimidine-2,4-dione.
What is the SMILES notation for 1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-5-fluoro-6-hydroxypyrimidine-2,4-dione?
The canonical SMILES for 1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-5-fluoro-6-hydroxypyrimidine-2,4-dione is CCc1nc(-n2c(O)c(F)c(=O)[nH]c2=O)sc1C.
What is the InChIKey of 1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-5-fluoro-6-hydroxypyrimidine-2,4-dione?
The InChIKey is FBHWKVDLAHUBTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN3O3S/c1-3-5-4(2)18-10(12-5)14-8(16)6(11)7(15)13-9(14)17/h16H,3H2,1-2H3,(H,13,15,17).
What are the key properties of 1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-5-fluoro-6-hydroxypyrimidine-2,4-dione?
1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-5-fluoro-6-hydroxypyrimidine-2,4-dione has a molecular weight of 271.27 g/mol, XLogP of 0.70, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-5-fluoro-6-hydroxypyrimidine-2,4-dione is sourced from PubChem (CID 112599774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).