N-(3-fluoro-2-pyridinyl)-1,3-thiazole-4-carboxamide

C9H6FN3OS — CID 155658858

IUPACN-(3-fluoro-2-pyridinyl)-1,3-thiazole-4-carboxamide
SMILESO=C(Nc1ncccc1F)c1cscn1
InChIInChI=1S/C9H6FN3OS/c10-6-2-1-3-11-8(6)13-9(14)7-4-15-5-12-7/h1-5H,(H,11,13,14)
InChIKeyXRMVDZHVWQZICW-UHFFFAOYSA-N
MW223.23 g/mol
LogP1.93
Rot. Bonds2

About N-(3-fluoro-2-pyridinyl)-1,3-thiazole-4-carboxamide

N-(3-fluoro-2-pyridinyl)-1,3-thiazole-4-carboxamide (PubChem CID 155658858) has the molecular formula C9H6FN3OS and a molecular weight of 223.23 g/mol. Its IUPAC name is N-(3-fluoro-2-pyridinyl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-(3-fluoro-2-pyridinyl)-1,3-thiazole-4-carboxamide
PubChem CID155658858
Molecular FormulaC9H6FN3OS
Molecular Weight223.23 g/mol
Exact Mass223.02
IUPAC NameN-(3-fluoro-2-pyridinyl)-1,3-thiazole-4-carboxamide
SMILESO=C(Nc1ncccc1F)c1cscn1
InChIInChI=1S/C9H6FN3OS/c10-6-2-1-3-11-8(6)13-9(14)7-4-15-5-12-7/h1-5H,(H,11,13,14)
InChIKeyXRMVDZHVWQZICW-UHFFFAOYSA-N
XLogP1.93
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.23
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-cyano-2-pyridinyl)-1,3-thiazole-4-carboxamide
CID 110471770
N-(3,4-difluorophenyl)-1,3-thiazole-4-carboxamide
CID 62045147
N-phenyl-1,3-thiazole-4-carboxamide
CID 62045972
N-(3-fluoro-2-pyridinyl)-4-iodobenzamide
CID 118465276
N-quinolin-6-yl-1,3-thiazole-4-carboxamide
CID 63047708
N-(5-fluoro-2-pyridinyl)-1,3-thiazole-4-carboxamide
CID 63235854
N-(2-chlorophenyl)-1,3-thiazole-4-carboxamide
CID 62046847
N-(2,6-dimethylphenyl)-1,3-thiazole-4-carboxamide
CID 62045312
N-(2,6-difluoro-3-pyridinyl)-1,3-thiazole-4-carboxamide
CID 103097885
N-(3-fluoro-2-pyridinyl)propanamide
CID 130249129
N-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxamide
CID 55142680
1,3-thiazole-4-carbohydrazide;hydrochloride
CID 146013643

Frequently Asked Questions

What is the IUPAC name of N-(3-fluoro-2-pyridinyl)-1,3-thiazole-4-carboxamide?
The IUPAC name of N-(3-fluoro-2-pyridinyl)-1,3-thiazole-4-carboxamide (CID 155658858) is N-(3-fluoro-2-pyridinyl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-(3-fluoro-2-pyridinyl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-(3-fluoro-2-pyridinyl)-1,3-thiazole-4-carboxamide is O=C(Nc1ncccc1F)c1cscn1.
What is the InChIKey of N-(3-fluoro-2-pyridinyl)-1,3-thiazole-4-carboxamide?
The InChIKey is XRMVDZHVWQZICW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6FN3OS/c10-6-2-1-3-11-8(6)13-9(14)7-4-15-5-12-7/h1-5H,(H,11,13,14).
What are the key properties of N-(3-fluoro-2-pyridinyl)-1,3-thiazole-4-carboxamide?
N-(3-fluoro-2-pyridinyl)-1,3-thiazole-4-carboxamide has a molecular weight of 223.23 g/mol, XLogP of 1.93, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoro-2-pyridinyl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 155658858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).