2-(2-fluorophenyl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrazole-3-carboxamide

C18H12FN5OS — CID 177207504

IUPAC2-(2-fluorophenyl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrazole-3-carboxamide
SMILESO=C(Nc1nc(-c2ccccn2)cs1)c1ccnn1-c1ccccc1F
InChIInChI=1S/C18H12FN5OS/c19-12-5-1-2-7-15(12)24-16(8-10-21-24)17(25)23-18-22-14(11-26-18)13-6-3-4-9-20-13/h1-11H,(H,22,23,25)
InChIKeyHEUHXUMUBMXHGZ-UHFFFAOYSA-N
MW365.39 g/mol
LogP3.78
Rot. Bonds4

About 2-(2-fluorophenyl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrazole-3-carboxamide

2-(2-fluorophenyl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrazole-3-carboxamide (PubChem CID 177207504) has the molecular formula C18H12FN5OS and a molecular weight of 365.39 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrazole-3-carboxamide.

Molecular Properties

Compound Name2-(2-fluorophenyl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrazole-3-carboxamide
PubChem CID177207504
Molecular FormulaC18H12FN5OS
Molecular Weight365.39 g/mol
Exact Mass365.07
IUPAC Name2-(2-fluorophenyl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrazole-3-carboxamide
SMILESO=C(Nc1nc(-c2ccccn2)cs1)c1ccnn1-c1ccccc1F
InChIInChI=1S/C18H12FN5OS/c19-12-5-1-2-7-15(12)24-16(8-10-21-24)17(25)23-18-22-14(11-26-18)13-6-3-4-9-20-13/h1-11H,(H,22,23,25)
InChIKeyHEUHXUMUBMXHGZ-UHFFFAOYSA-N
XLogP3.78
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.39
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrazole-3-carboxamide?
The IUPAC name of 2-(2-fluorophenyl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrazole-3-carboxamide (CID 177207504) is 2-(2-fluorophenyl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrazole-3-carboxamide.
What is the SMILES notation for 2-(2-fluorophenyl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrazole-3-carboxamide?
The canonical SMILES for 2-(2-fluorophenyl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrazole-3-carboxamide is O=C(Nc1nc(-c2ccccn2)cs1)c1ccnn1-c1ccccc1F.
What is the InChIKey of 2-(2-fluorophenyl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrazole-3-carboxamide?
The InChIKey is HEUHXUMUBMXHGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12FN5OS/c19-12-5-1-2-7-15(12)24-16(8-10-21-24)17(25)23-18-22-14(11-26-18)13-6-3-4-9-20-13/h1-11H,(H,22,23,25).
What are the key properties of 2-(2-fluorophenyl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrazole-3-carboxamide?
2-(2-fluorophenyl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrazole-3-carboxamide has a molecular weight of 365.39 g/mol, XLogP of 3.78, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrazole-3-carboxamide is sourced from PubChem (CID 177207504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).