N-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazole-6-carboxamide

C11H7FN4OS — CID 110858720

IUPACN-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazole-6-carboxamide
SMILESO=C(Nc1ccc(F)cc1)c1cn2ncsc2n1
InChIInChI=1S/C11H7FN4OS/c12-7-1-3-8(4-2-7)14-10(17)9-5-16-11(15-9)18-6-13-16/h1-6H,(H,14,17)
InChIKeyROVIREPFEMEVEL-UHFFFAOYSA-N
MW262.27 g/mol
LogP2.18
Rot. Bonds2

About N-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazole-6-carboxamide

N-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazole-6-carboxamide (PubChem CID 110858720) has the molecular formula C11H7FN4OS and a molecular weight of 262.27 g/mol. Its IUPAC name is N-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazole-6-carboxamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazole-6-carboxamide
PubChem CID110858720
Molecular FormulaC11H7FN4OS
Molecular Weight262.27 g/mol
Exact Mass262.03
IUPAC NameN-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazole-6-carboxamide
SMILESO=C(Nc1ccc(F)cc1)c1cn2ncsc2n1
InChIInChI=1S/C11H7FN4OS/c12-7-1-3-8(4-2-7)14-10(17)9-5-16-11(15-9)18-6-13-16/h1-6H,(H,14,17)
InChIKeyROVIREPFEMEVEL-UHFFFAOYSA-N
XLogP2.18
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.27
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-cyanophenyl)imidazo[2,1-b][1,3,4]thiadiazole-6-carboxamide
CID 110864985
N-(3,5-dimethylphenyl)imidazo[2,1-b][1,3,4]thiadiazole-6-carboxamide
CID 110857504
N-(3-chlorophenyl)imidazo[2,1-b][1,3,4]thiadiazole-6-carboxamide
CID 110858903
N-(2,6-dimethylphenyl)imidazo[2,1-b][1,3,4]thiadiazole-6-carboxamide
CID 110857587
N-(4-fluorophenyl)-1,3-thiazole-5-carboxamide
CID 5299224
2-[[bis[(4-fluorophenyl)methyl]amino]methyl]-N-(4-fluorophenyl)-1,3-thiazole-4-carboxamide
CID 1032477
N-(4-fluorophenyl)-2-piperidin-1-yl-1,3-thiazole-4-carboxamide;hydrochloride
CID 69168862
N-(4-bromophenyl)-2-methylimidazo[2,1-b][1,3,4]thiadiazole-6-carboxamide
CID 110859730
N-(4-fluorophenyl)-2,6-dimethylpyrimidine-4-carboxamide
CID 110858651
N-(4-fluorophenyl)-5-methyl-1,3-thiazole-4-carboxamide
CID 110858632
6-amino-N-(4-fluorophenyl)pyridazine-3-carboxamide
CID 62155228
N-(4-fluorophenyl)-5-oxo-1,2,4-dithiazole-3-carboxamide
CID 12025376

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazole-6-carboxamide?
The IUPAC name of N-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazole-6-carboxamide (CID 110858720) is N-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazole-6-carboxamide.
What is the SMILES notation for N-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazole-6-carboxamide?
The canonical SMILES for N-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazole-6-carboxamide is O=C(Nc1ccc(F)cc1)c1cn2ncsc2n1.
What is the InChIKey of N-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazole-6-carboxamide?
The InChIKey is ROVIREPFEMEVEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7FN4OS/c12-7-1-3-8(4-2-7)14-10(17)9-5-16-11(15-9)18-6-13-16/h1-6H,(H,14,17).
What are the key properties of N-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazole-6-carboxamide?
N-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazole-6-carboxamide has a molecular weight of 262.27 g/mol, XLogP of 2.18, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazole-6-carboxamide is sourced from PubChem (CID 110858720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).