3-fluoro-5-(trifluoromethyl)pyridine-2-carboxamide

C7H4F4N2O — CID 66545196

IUPAC3-fluoro-5-(trifluoromethyl)pyridine-2-carboxamide
SMILESNC(=O)c1ncc(C(F)(F)F)cc1F
InChIInChI=1S/C7H4F4N2O/c8-4-1-3(7(9,10)11)2-13-5(4)6(12)14/h1-2H,(H2,12,14)
InChIKeyRENAIDXERMUVMQ-UHFFFAOYSA-N
MW208.11 g/mol
LogP1.34
Rot. Bonds1

About 3-fluoro-5-(trifluoromethyl)pyridine-2-carboxamide

3-fluoro-5-(trifluoromethyl)pyridine-2-carboxamide (PubChem CID 66545196) has the molecular formula C7H4F4N2O and a molecular weight of 208.11 g/mol. Its IUPAC name is 3-fluoro-5-(trifluoromethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-fluoro-5-(trifluoromethyl)pyridine-2-carboxamide
PubChem CID66545196
Molecular FormulaC7H4F4N2O
Molecular Weight208.11 g/mol
Exact Mass208.03
IUPAC Name3-fluoro-5-(trifluoromethyl)pyridine-2-carboxamide
SMILESNC(=O)c1ncc(C(F)(F)F)cc1F
InChIInChI=1S/C7H4F4N2O/c8-4-1-3(7(9,10)11)2-13-5(4)6(12)14/h1-2H,(H2,12,14)
InChIKeyRENAIDXERMUVMQ-UHFFFAOYSA-N
XLogP1.34
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.11
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-5-(trifluoromethyl)pyridine-2-carboxamide?
The IUPAC name of 3-fluoro-5-(trifluoromethyl)pyridine-2-carboxamide (CID 66545196) is 3-fluoro-5-(trifluoromethyl)pyridine-2-carboxamide.
What is the SMILES notation for 3-fluoro-5-(trifluoromethyl)pyridine-2-carboxamide?
The canonical SMILES for 3-fluoro-5-(trifluoromethyl)pyridine-2-carboxamide is NC(=O)c1ncc(C(F)(F)F)cc1F.
What is the InChIKey of 3-fluoro-5-(trifluoromethyl)pyridine-2-carboxamide?
The InChIKey is RENAIDXERMUVMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4F4N2O/c8-4-1-3(7(9,10)11)2-13-5(4)6(12)14/h1-2H,(H2,12,14).
What are the key properties of 3-fluoro-5-(trifluoromethyl)pyridine-2-carboxamide?
3-fluoro-5-(trifluoromethyl)pyridine-2-carboxamide has a molecular weight of 208.11 g/mol, XLogP of 1.34, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-5-(trifluoromethyl)pyridine-2-carboxamide is sourced from PubChem (CID 66545196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).