3-(4-fluorophenyl)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)imidazole-4-carboxamide

C18H12FN5OS — CID 18127545

IUPAC3-(4-fluorophenyl)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)imidazole-4-carboxamide
SMILESO=C(Nc1nc(-c2cccnc2)cs1)c1cncn1-c1ccc(F)cc1
InChIInChI=1S/C18H12FN5OS/c19-13-3-5-14(6-4-13)24-11-21-9-16(24)17(25)23-18-22-15(10-26-18)12-2-1-7-20-8-12/h1-11H,(H,22,23,25)
InChIKeyGBTQPSYGFKGPCE-UHFFFAOYSA-N
MW365.39 g/mol
LogP3.78
Rot. Bonds4

About 3-(4-fluorophenyl)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)imidazole-4-carboxamide

3-(4-fluorophenyl)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)imidazole-4-carboxamide (PubChem CID 18127545) has the molecular formula C18H12FN5OS and a molecular weight of 365.39 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)imidazole-4-carboxamide.

Molecular Properties

Compound Name3-(4-fluorophenyl)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)imidazole-4-carboxamide
PubChem CID18127545
Molecular FormulaC18H12FN5OS
Molecular Weight365.39 g/mol
Exact Mass365.07
IUPAC Name3-(4-fluorophenyl)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)imidazole-4-carboxamide
SMILESO=C(Nc1nc(-c2cccnc2)cs1)c1cncn1-c1ccc(F)cc1
InChIInChI=1S/C18H12FN5OS/c19-13-3-5-14(6-4-13)24-11-21-9-16(24)17(25)23-18-22-15(10-26-18)12-2-1-7-20-8-12/h1-11H,(H,22,23,25)
InChIKeyGBTQPSYGFKGPCE-UHFFFAOYSA-N
XLogP3.78
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.39
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[4-(5-fluoro-2-pyridinyl)-1,3-thiazol-2-yl]-3-pyridin-4-ylimidazole-4-carboxamide
CID 176859446
N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-3-phenylimidazole-4-carboxamide
CID 60592826
3-(4-fluorophenyl)-N-(2-methyl-5-pyridin-3-ylphenyl)imidazole-4-carboxamide
CID 166222014
2-[(4-fluorophenyl)methyl]-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)-1,3-thiazole-4-carboxamide
CID 75466812
N-(4-pyridin-3-yl-1,3-thiazol-2-yl)-4-pyrrol-1-ylbenzamide
CID 17450848
N-[4-(5-ethoxy-2-pyridinyl)-1,3-thiazol-2-yl]-3-pyridin-3-ylimidazole-4-carboxamide
CID 176858480
4-(4-fluorobenzoyl)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)piperazine-1-carboxamide
CID 78875156
4-morpholin-4-yl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide
CID 162386909
N-[4-(6-methoxy-2-pyridinyl)-1,3-thiazol-2-yl]-3-phenylimidazole-4-carboxamide
CID 176859684
1-(4-fluorophenyl)-N-(4-phenyl-1,3-thiazol-2-yl)pyrazole-3-carboxamide
CID 43071659
2,4-dichloro-5-fluoro-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide
CID 18277166
N-[4-(5-methoxy-2-pyridinyl)-1,3-thiazol-2-yl]-3-phenylimidazole-4-carboxamide
CID 176859832

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)imidazole-4-carboxamide?
The IUPAC name of 3-(4-fluorophenyl)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)imidazole-4-carboxamide (CID 18127545) is 3-(4-fluorophenyl)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)imidazole-4-carboxamide.
What is the SMILES notation for 3-(4-fluorophenyl)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)imidazole-4-carboxamide?
The canonical SMILES for 3-(4-fluorophenyl)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)imidazole-4-carboxamide is O=C(Nc1nc(-c2cccnc2)cs1)c1cncn1-c1ccc(F)cc1.
What is the InChIKey of 3-(4-fluorophenyl)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)imidazole-4-carboxamide?
The InChIKey is GBTQPSYGFKGPCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12FN5OS/c19-13-3-5-14(6-4-13)24-11-21-9-16(24)17(25)23-18-22-15(10-26-18)12-2-1-7-20-8-12/h1-11H,(H,22,23,25).
What are the key properties of 3-(4-fluorophenyl)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)imidazole-4-carboxamide?
3-(4-fluorophenyl)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)imidazole-4-carboxamide has a molecular weight of 365.39 g/mol, XLogP of 3.78, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)imidazole-4-carboxamide is sourced from PubChem (CID 18127545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).