N-(4-fluorophenyl)-2-(4-methyl-1,3-thiazol-5-yl)pyridine-3-carboxamide

C16H12FN3OS — CID 110131656

IUPACN-(4-fluorophenyl)-2-(4-methyl-1,3-thiazol-5-yl)pyridine-3-carboxamide
SMILESCc1ncsc1-c1ncccc1C(=O)Nc1ccc(F)cc1
InChIInChI=1S/C16H12FN3OS/c1-10-15(22-9-19-10)14-13(3-2-8-18-14)16(21)20-12-6-4-11(17)5-7-12/h2-9H,1H3,(H,20,21)
InChIKeyFSZIPCLSOHCERR-UHFFFAOYSA-N
MW313.36 g/mol
LogP3.90
Rot. Bonds3

About N-(4-fluorophenyl)-2-(4-methyl-1,3-thiazol-5-yl)pyridine-3-carboxamide

N-(4-fluorophenyl)-2-(4-methyl-1,3-thiazol-5-yl)pyridine-3-carboxamide (PubChem CID 110131656) has the molecular formula C16H12FN3OS and a molecular weight of 313.36 g/mol. Its IUPAC name is N-(4-fluorophenyl)-2-(4-methyl-1,3-thiazol-5-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-2-(4-methyl-1,3-thiazol-5-yl)pyridine-3-carboxamide
PubChem CID110131656
Molecular FormulaC16H12FN3OS
Molecular Weight313.36 g/mol
Exact Mass313.07
IUPAC NameN-(4-fluorophenyl)-2-(4-methyl-1,3-thiazol-5-yl)pyridine-3-carboxamide
SMILESCc1ncsc1-c1ncccc1C(=O)Nc1ccc(F)cc1
InChIInChI=1S/C16H12FN3OS/c1-10-15(22-9-19-10)14-13(3-2-8-18-14)16(21)20-12-6-4-11(17)5-7-12/h2-9H,1H3,(H,20,21)
InChIKeyFSZIPCLSOHCERR-UHFFFAOYSA-N
XLogP3.90
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-fluorophenyl)-5-methyl-1,3-thiazole-4-carboxamide
CID 110858632
ethyl 4-[(2-thiophen-2-ylpyridine-3-carbonyl)amino]benzoate
CID 46388667
N-(4-fluorophenyl)-3-methylpyridine-4-carboxamide
CID 110858696
N-[4-(cyanomethyl)phenyl]-2-methylpyridine-3-carboxamide
CID 78950821
2-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-3-carboxamide
CID 78950943
2-(3-fluoroanilino)-N-(4-methylphenyl)pyridine-3-carboxamide
CID 23632400
N-(4-fluorophenyl)-1,3-dimethylpyrazole-4-carboxamide
CID 45285306
2-amino-N-(3,5-difluorophenyl)pyridine-3-carboxamide
CID 62154038
2-fluoro-N-(6-fluoro-3-pyridinyl)pyridine-3-carboxamide
CID 107358891
N-(4-fluorophenyl)-3-methyl-2-pyrazol-1-ylbenzamide
CID 122380407
2-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide
CID 110862622
N-(4-fluorophenyl)-2-[4-(trifluoromethoxy)anilino]pyridine-3-carboxamide
CID 23632434

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-2-(4-methyl-1,3-thiazol-5-yl)pyridine-3-carboxamide?
The IUPAC name of N-(4-fluorophenyl)-2-(4-methyl-1,3-thiazol-5-yl)pyridine-3-carboxamide (CID 110131656) is N-(4-fluorophenyl)-2-(4-methyl-1,3-thiazol-5-yl)pyridine-3-carboxamide.
What is the SMILES notation for N-(4-fluorophenyl)-2-(4-methyl-1,3-thiazol-5-yl)pyridine-3-carboxamide?
The canonical SMILES for N-(4-fluorophenyl)-2-(4-methyl-1,3-thiazol-5-yl)pyridine-3-carboxamide is Cc1ncsc1-c1ncccc1C(=O)Nc1ccc(F)cc1.
What is the InChIKey of N-(4-fluorophenyl)-2-(4-methyl-1,3-thiazol-5-yl)pyridine-3-carboxamide?
The InChIKey is FSZIPCLSOHCERR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12FN3OS/c1-10-15(22-9-19-10)14-13(3-2-8-18-14)16(21)20-12-6-4-11(17)5-7-12/h2-9H,1H3,(H,20,21).
What are the key properties of N-(4-fluorophenyl)-2-(4-methyl-1,3-thiazol-5-yl)pyridine-3-carboxamide?
N-(4-fluorophenyl)-2-(4-methyl-1,3-thiazol-5-yl)pyridine-3-carboxamide has a molecular weight of 313.36 g/mol, XLogP of 3.90, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-2-(4-methyl-1,3-thiazol-5-yl)pyridine-3-carboxamide is sourced from PubChem (CID 110131656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).