6-fluoro-N-(1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide

C8H5FN4OS — CID 115496715

IUPAC6-fluoro-N-(1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide
SMILESO=C(Nc1nncs1)c1cccc(F)n1
InChIInChI=1S/C8H5FN4OS/c9-6-3-1-2-5(11-6)7(14)12-8-13-10-4-15-8/h1-4H,(H,12,13,14)
InChIKeyNBHXMLWNKKFTJV-UHFFFAOYSA-N
MW224.22 g/mol
LogP1.32
Rot. Bonds2

About 6-fluoro-N-(1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide

6-fluoro-N-(1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide (PubChem CID 115496715) has the molecular formula C8H5FN4OS and a molecular weight of 224.22 g/mol. Its IUPAC name is 6-fluoro-N-(1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-fluoro-N-(1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide
PubChem CID115496715
Molecular FormulaC8H5FN4OS
Molecular Weight224.22 g/mol
Exact Mass224.02
IUPAC Name6-fluoro-N-(1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide
SMILESO=C(Nc1nncs1)c1cccc(F)n1
InChIInChI=1S/C8H5FN4OS/c9-6-3-1-2-5(11-6)7(14)12-8-13-10-4-15-8/h1-4H,(H,12,13,14)
InChIKeyNBHXMLWNKKFTJV-UHFFFAOYSA-N
XLogP1.32
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.22
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N-(4-tert-butyl-1,3-thiazol-2-yl)-6-fluoropyridine-2-carboxamide
CID 113323542
5-[(6-fluoropyridine-2-carbonyl)amino]thiophene-2-carboxylic acid
CID 113323241
N-(4-carbamoylphenyl)-6-fluoropyridine-2-carboxamide
CID 115496681
1-amino-N-(1,3,4-thiadiazol-2-yl)isoquinoline-3-carboxamide
CID 62151425
2-chloro-4-fluoro-N-(1,3,4-thiadiazol-2-yl)benzamide
CID 6469162
4-amino-N-(1,3,4-thiadiazol-2-yl)quinoline-2-carboxamide
CID 63377505
N-(1,3,4-thiadiazol-2-yl)-1H-pyrrole-3-carboxamide
CID 130649691
N-(4-chloro-2-fluorophenyl)-6-fluoropyridine-2-carboxamide
CID 113323409
N-(2-bromo-3-chlorophenyl)-6-fluoropyridine-2-carboxamide
CID 103478796
2-fluoro-4-hydroxy-N-(1,3,4-thiadiazol-2-yl)benzamide
CID 103940013
6-fluoro-N-[4-(propanoylamino)phenyl]pyridine-2-carboxamide
CID 115497261
N-(6-chloro-2-methyl-3-pyridinyl)-6-fluoropyridine-2-carboxamide
CID 107301196

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-N-(1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide?
The IUPAC name of 6-fluoro-N-(1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide (CID 115496715) is 6-fluoro-N-(1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide.
What is the SMILES notation for 6-fluoro-N-(1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide?
The canonical SMILES for 6-fluoro-N-(1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide is O=C(Nc1nncs1)c1cccc(F)n1.
What is the InChIKey of 6-fluoro-N-(1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide?
The InChIKey is NBHXMLWNKKFTJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5FN4OS/c9-6-3-1-2-5(11-6)7(14)12-8-13-10-4-15-8/h1-4H,(H,12,13,14).
What are the key properties of 6-fluoro-N-(1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide?
6-fluoro-N-(1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide has a molecular weight of 224.22 g/mol, XLogP of 1.32, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-(1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide is sourced from PubChem (CID 115496715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).