2,6-difluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide

C15H9F2N3OS — CID 73348030

IUPAC2,6-difluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide
SMILESO=C(Nc1nc(-c2ccccn2)cs1)c1c(F)cccc1F
InChIInChI=1S/C15H9F2N3OS/c16-9-4-3-5-10(17)13(9)14(21)20-15-19-12(8-22-15)11-6-1-2-7-18-11/h1-8H,(H,19,20,21)
InChIKeyMXJLAWWWLWGUEJ-UHFFFAOYSA-N
MW317.32 g/mol
LogP3.74
Rot. Bonds3

About 2,6-difluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide

2,6-difluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide (PubChem CID 73348030) has the molecular formula C15H9F2N3OS and a molecular weight of 317.32 g/mol. Its IUPAC name is 2,6-difluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name2,6-difluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide
PubChem CID73348030
Molecular FormulaC15H9F2N3OS
Molecular Weight317.32 g/mol
Exact Mass317.04
IUPAC Name2,6-difluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide
SMILESO=C(Nc1nc(-c2ccccn2)cs1)c1c(F)cccc1F
InChIInChI=1S/C15H9F2N3OS/c16-9-4-3-5-10(17)13(9)14(21)20-15-19-12(8-22-15)11-6-1-2-7-18-11/h1-8H,(H,19,20,21)
InChIKeyMXJLAWWWLWGUEJ-UHFFFAOYSA-N
XLogP3.74
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.32
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,3,4-trifluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide
CID 108744422
3-(2-chloro-6-fluorophenyl)-5-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,2-oxazole-4-carboxamide
CID 176859822
2-(2-chloro-6-fluorophenyl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide
CID 4800248
2,5-dichloro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide
CID 5003941
2,6-difluoro-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)benzamide
CID 31171489
3-nitro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide
CID 4158043
3-(3-fluorophenyl)-5-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,2-oxazole-4-carboxamide
CID 176858449
5-bromo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)thiophene-2-carboxamide
CID 2354167
trimethyl-[(4-pyridin-2-yl-1,3-thiazol-2-yl)carbamoyl]azanium
CID 155924019
4-benzyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide
CID 4646220
1-phenyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-3,5-bis(trifluoromethyl)pyrazole-4-carboxamide
CID 176859269
2-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)furan-3-carboxamide
CID 17427879

Frequently Asked Questions

What is the IUPAC name of 2,6-difluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 2,6-difluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide (CID 73348030) is 2,6-difluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 2,6-difluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 2,6-difluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide is O=C(Nc1nc(-c2ccccn2)cs1)c1c(F)cccc1F.
What is the InChIKey of 2,6-difluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide?
The InChIKey is MXJLAWWWLWGUEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9F2N3OS/c16-9-4-3-5-10(17)13(9)14(21)20-15-19-12(8-22-15)11-6-1-2-7-18-11/h1-8H,(H,19,20,21).
What are the key properties of 2,6-difluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide?
2,6-difluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide has a molecular weight of 317.32 g/mol, XLogP of 3.74, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-difluoro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 73348030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).