N-(4-fluorophenyl)-5-oxo-2,3,6,7-tetrahydroimidazo[2,1-b][1,3]thiazine-7-carboxamide

C13H12FN3O2S — CID 3155925

IUPACN-(4-fluorophenyl)-5-oxo-2,3,6,7-tetrahydroimidazo[2,1-b][1,3]thiazine-7-carboxamide
SMILESO=C(Nc1ccc(F)cc1)C1CC(=O)N2CCN=C2S1
InChIInChI=1S/C13H12FN3O2S/c14-8-1-3-9(4-2-8)16-12(19)10-7-11(18)17-6-5-15-13(17)20-10/h1-4,10H,5-7H2,(H,16,19)
InChIKeyRWPVILOEKJZMMA-UHFFFAOYSA-N
MW293.32 g/mol
LogP1.47
Rot. Bonds2

About N-(4-fluorophenyl)-5-oxo-2,3,6,7-tetrahydroimidazo[2,1-b][1,3]thiazine-7-carboxamide

N-(4-fluorophenyl)-5-oxo-2,3,6,7-tetrahydroimidazo[2,1-b][1,3]thiazine-7-carboxamide (PubChem CID 3155925) has the molecular formula C13H12FN3O2S and a molecular weight of 293.32 g/mol. Its IUPAC name is N-(4-fluorophenyl)-5-oxo-2,3,6,7-tetrahydroimidazo[2,1-b][1,3]thiazine-7-carboxamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-5-oxo-2,3,6,7-tetrahydroimidazo[2,1-b][1,3]thiazine-7-carboxamide
PubChem CID3155925
Molecular FormulaC13H12FN3O2S
Molecular Weight293.32 g/mol
Exact Mass293.06
IUPAC NameN-(4-fluorophenyl)-5-oxo-2,3,6,7-tetrahydroimidazo[2,1-b][1,3]thiazine-7-carboxamide
SMILESO=C(Nc1ccc(F)cc1)C1CC(=O)N2CCN=C2S1
InChIInChI=1S/C13H12FN3O2S/c14-8-1-3-9(4-2-8)16-12(19)10-7-11(18)17-6-5-15-13(17)20-10/h1-4,10H,5-7H2,(H,16,19)
InChIKeyRWPVILOEKJZMMA-UHFFFAOYSA-N
XLogP1.47
TPSA61.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.32
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(4-fluorophenyl)-5-oxo-2,3,6,7-tetrahydroimidazo[2,1-b][1,3]thiazine-7-carboxamide 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

(2Z)-N-(3-chlorophenyl)-3-ethyl-2-(ethylimino)-4-oxo-1,3-thiazinane-6-carboxamide
CID 3139557
2-(3-oxo-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazol-2-yl)-N-phenylacetamide
CID 661432
N-ethyl-7-[(N-ethyl-4-fluoroanilino)methyl]-2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide
CID 122438475
2-[(2E)-2-(cyclohexylimino)-4-oxo-1,3-thiazolidin-5-yl]-N-phenylacetamide
CID 135403874
N-(5,6-Dihydro-4H-[1,3]thiazin-2-yl)-N-(2-fluoro-phenyl)-acetamide
CID 646627
N-(4,5-dihydro-1,3-thiazol-2-yl)-5-oxo-1-phenylpyrrolidine-3-carboxamide
CID 647039
1-(4-fluorophenyl)-2,5-dioxo-3-pyrrolidinyl N,N'-diethylimidothiocarbamate
CID 2840626
2-[(2Z)-3-ethyl-2-(ethylimino)-4-oxo-1,3-thiazolidin-5-yl]-N-phenylacetamide
CID 2998505
3-Ethyl-2-ethylimino-4-oxo-[1,3]thiazinane-6-carboxylic acid m-tolylamide
CID 3139558
1-(4-Fluoro-phenyl)-5-oxo-pyrrolidine-3-carboxylic acid (4,5-dihydro-thiazol-2-yl)-amide
CID 3155569
2-[(3-ethyl-6-methyl-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]-N-(2-fluorophenyl)acetamide
CID 3236056
2-((3,6-dimethyl-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl)thio)-N-(4-fluorophenyl)acetamide
CID 3239552

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-5-oxo-2,3,6,7-tetrahydroimidazo[2,1-b][1,3]thiazine-7-carboxamide?
The IUPAC name of N-(4-fluorophenyl)-5-oxo-2,3,6,7-tetrahydroimidazo[2,1-b][1,3]thiazine-7-carboxamide (CID 3155925) is N-(4-fluorophenyl)-5-oxo-2,3,6,7-tetrahydroimidazo[2,1-b][1,3]thiazine-7-carboxamide.
What is the SMILES notation for N-(4-fluorophenyl)-5-oxo-2,3,6,7-tetrahydroimidazo[2,1-b][1,3]thiazine-7-carboxamide?
The canonical SMILES for N-(4-fluorophenyl)-5-oxo-2,3,6,7-tetrahydroimidazo[2,1-b][1,3]thiazine-7-carboxamide is O=C(Nc1ccc(F)cc1)C1CC(=O)N2CCN=C2S1.
What is the InChIKey of N-(4-fluorophenyl)-5-oxo-2,3,6,7-tetrahydroimidazo[2,1-b][1,3]thiazine-7-carboxamide?
The InChIKey is RWPVILOEKJZMMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FN3O2S/c14-8-1-3-9(4-2-8)16-12(19)10-7-11(18)17-6-5-15-13(17)20-10/h1-4,10H,5-7H2,(H,16,19).
What are the key properties of N-(4-fluorophenyl)-5-oxo-2,3,6,7-tetrahydroimidazo[2,1-b][1,3]thiazine-7-carboxamide?
N-(4-fluorophenyl)-5-oxo-2,3,6,7-tetrahydroimidazo[2,1-b][1,3]thiazine-7-carboxamide has a molecular weight of 293.32 g/mol, XLogP of 1.47, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-5-oxo-2,3,6,7-tetrahydroimidazo[2,1-b][1,3]thiazine-7-carboxamide is sourced from PubChem (CID 3155925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).