6-pyridin-2-yl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide

C15H9F3N4OS — CID 169101821

IUPAC6-pyridin-2-yl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide
SMILESO=C(Nc1nc(C(F)(F)F)cs1)c1cccc(-c2ccccn2)n1
InChIInChI=1S/C15H9F3N4OS/c16-15(17,18)12-8-24-14(21-12)22-13(23)11-6-3-5-10(20-11)9-4-1-2-7-19-9/h1-8H,(H,21,22,23)
InChIKeyUJXLGVMOZYWRBT-UHFFFAOYSA-N
MW350.33 g/mol
LogP3.87
Rot. Bonds3

About 6-pyridin-2-yl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide

6-pyridin-2-yl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide (PubChem CID 169101821) has the molecular formula C15H9F3N4OS and a molecular weight of 350.33 g/mol. Its IUPAC name is 6-pyridin-2-yl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-pyridin-2-yl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide
PubChem CID169101821
Molecular FormulaC15H9F3N4OS
Molecular Weight350.33 g/mol
Exact Mass350.04
IUPAC Name6-pyridin-2-yl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide
SMILESO=C(Nc1nc(C(F)(F)F)cs1)c1cccc(-c2ccccn2)n1
InChIInChI=1S/C15H9F3N4OS/c16-15(17,18)12-8-24-14(21-12)22-13(23)11-6-3-5-10(20-11)9-4-1-2-7-19-9/h1-8H,(H,21,22,23)
InChIKeyUJXLGVMOZYWRBT-UHFFFAOYSA-N
XLogP3.87
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.33
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

CID 790259
CID 790259
CID 203433
CID 203433
CID 4119262
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CID 11313388
CID 11313388
CID 2463754
CID 2463754
CID 2576269
CID 2576269
CID 2660463
CID 2660463
CID 10402473
CID 10402473
CID 2594420
CID 2594420
CID 3267821
CID 3267821
CID 4782304
CID 4782304
CID 1070711
CID 1070711

Frequently Asked Questions

What is the IUPAC name of 6-pyridin-2-yl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide?
The IUPAC name of 6-pyridin-2-yl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide (CID 169101821) is 6-pyridin-2-yl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide.
What is the SMILES notation for 6-pyridin-2-yl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide?
The canonical SMILES for 6-pyridin-2-yl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide is O=C(Nc1nc(C(F)(F)F)cs1)c1cccc(-c2ccccn2)n1.
What is the InChIKey of 6-pyridin-2-yl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide?
The InChIKey is UJXLGVMOZYWRBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9F3N4OS/c16-15(17,18)12-8-24-14(21-12)22-13(23)11-6-3-5-10(20-11)9-4-1-2-7-19-9/h1-8H,(H,21,22,23).
What are the key properties of 6-pyridin-2-yl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide?
6-pyridin-2-yl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide has a molecular weight of 350.33 g/mol, XLogP of 3.87, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-pyridin-2-yl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide is sourced from PubChem (CID 169101821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).