N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methoxypyridine-3-carboxamide

C14H10FN3O2S — CID 134709205

IUPACN-(4-fluoro-1,3-benzothiazol-2-yl)-2-methoxypyridine-3-carboxamide
SMILESCOc1ncccc1C(=O)Nc1nc2c(F)cccc2s1
InChIInChI=1S/C14H10FN3O2S/c1-20-13-8(4-3-7-16-13)12(19)18-14-17-11-9(15)5-2-6-10(11)21-14/h2-7H,1H3,(H,17,18,19)
InChIKeyXDJJQMRONOPTCC-UHFFFAOYSA-N
MW303.32 g/mol
LogP3.09
Rot. Bonds3

About N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methoxypyridine-3-carboxamide

N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methoxypyridine-3-carboxamide (PubChem CID 134709205) has the molecular formula C14H10FN3O2S and a molecular weight of 303.32 g/mol. Its IUPAC name is N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-fluoro-1,3-benzothiazol-2-yl)-2-methoxypyridine-3-carboxamide
PubChem CID134709205
Molecular FormulaC14H10FN3O2S
Molecular Weight303.32 g/mol
Exact Mass303.05
IUPAC NameN-(4-fluoro-1,3-benzothiazol-2-yl)-2-methoxypyridine-3-carboxamide
SMILESCOc1ncccc1C(=O)Nc1nc2c(F)cccc2s1
InChIInChI=1S/C14H10FN3O2S/c1-20-13-8(4-3-7-16-13)12(19)18-14-17-11-9(15)5-2-6-10(11)21-14/h2-7H,1H3,(H,17,18,19)
InChIKeyXDJJQMRONOPTCC-UHFFFAOYSA-N
XLogP3.09
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.32
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-fluoro-1,3-benzothiazol-2-yl)-2,4-dimethoxybenzamide
CID 7193198
2-chloro-N-(4-fluoro-1,3-benzothiazol-2-yl)benzamide
CID 7193186
N-(4-fluoro-1,3-benzothiazol-2-yl)-2-iodobenzamide
CID 7193259
N-(3-fluoro-2-iodophenyl)-2-methoxypyridine-3-carboxamide
CID 113340929
N-(4-fluoro-1,3-benzothiazol-2-yl)-1-methylimidazole-2-carboxamide
CID 43989277
N-(4-ethoxy-1,3-benzothiazol-2-yl)-2-fluorobenzamide
CID 867640
2-methoxy-N-(5-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 46557890
N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methoxyacetamide
CID 53269300
4-(dimethylamino)-N-(4-fluoro-1,3-benzothiazol-2-yl)benzamide
CID 7152616
2-methoxy-N-(4-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 46557524
2-ethoxy-N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methylpropanamide
CID 134714245
N-(4-ethoxy-1,3-benzothiazol-2-yl)-2-methoxybenzamide
CID 19214365

Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methoxypyridine-3-carboxamide?
The IUPAC name of N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methoxypyridine-3-carboxamide (CID 134709205) is N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methoxypyridine-3-carboxamide.
What is the SMILES notation for N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methoxypyridine-3-carboxamide?
The canonical SMILES for N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methoxypyridine-3-carboxamide is COc1ncccc1C(=O)Nc1nc2c(F)cccc2s1.
What is the InChIKey of N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methoxypyridine-3-carboxamide?
The InChIKey is XDJJQMRONOPTCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10FN3O2S/c1-20-13-8(4-3-7-16-13)12(19)18-14-17-11-9(15)5-2-6-10(11)21-14/h2-7H,1H3,(H,17,18,19).
What are the key properties of N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methoxypyridine-3-carboxamide?
N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methoxypyridine-3-carboxamide has a molecular weight of 303.32 g/mol, XLogP of 3.09, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methoxypyridine-3-carboxamide is sourced from PubChem (CID 134709205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).