6-(3-chloro-4-fluorophenyl)-N-(1,3-oxazol-2-yl)pyridine-2-carboxamide

C15H9ClFN3O2 — CID 162429839

IUPAC6-(3-chloro-4-fluorophenyl)-N-(1,3-oxazol-2-yl)pyridine-2-carboxamide
SMILESO=C(Nc1ncco1)c1cccc(-c2ccc(F)c(Cl)c2)n1
InChIInChI=1S/C15H9ClFN3O2/c16-10-8-9(4-5-11(10)17)12-2-1-3-13(19-12)14(21)20-15-18-6-7-22-15/h1-8H,(H,18,20,21)
InChIKeyNWGRWYJFQVHHIT-UHFFFAOYSA-N
MW317.71 g/mol
LogP3.78
Rot. Bonds3

About 6-(3-chloro-4-fluorophenyl)-N-(1,3-oxazol-2-yl)pyridine-2-carboxamide

6-(3-chloro-4-fluorophenyl)-N-(1,3-oxazol-2-yl)pyridine-2-carboxamide (PubChem CID 162429839) has the molecular formula C15H9ClFN3O2 and a molecular weight of 317.71 g/mol. Its IUPAC name is 6-(3-chloro-4-fluorophenyl)-N-(1,3-oxazol-2-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-(3-chloro-4-fluorophenyl)-N-(1,3-oxazol-2-yl)pyridine-2-carboxamide
PubChem CID162429839
Molecular FormulaC15H9ClFN3O2
Molecular Weight317.71 g/mol
Exact Mass317.04
IUPAC Name6-(3-chloro-4-fluorophenyl)-N-(1,3-oxazol-2-yl)pyridine-2-carboxamide
SMILESO=C(Nc1ncco1)c1cccc(-c2ccc(F)c(Cl)c2)n1
InChIInChI=1S/C15H9ClFN3O2/c16-10-8-9(4-5-11(10)17)12-2-1-3-13(19-12)14(21)20-15-18-6-7-22-15/h1-8H,(H,18,20,21)
InChIKeyNWGRWYJFQVHHIT-UHFFFAOYSA-N
XLogP3.78
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.71
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(3-chloro-4-fluorophenyl)-N-(1,3-oxazol-2-yl)pyridine-2-carboxamide?
The IUPAC name of 6-(3-chloro-4-fluorophenyl)-N-(1,3-oxazol-2-yl)pyridine-2-carboxamide (CID 162429839) is 6-(3-chloro-4-fluorophenyl)-N-(1,3-oxazol-2-yl)pyridine-2-carboxamide.
What is the SMILES notation for 6-(3-chloro-4-fluorophenyl)-N-(1,3-oxazol-2-yl)pyridine-2-carboxamide?
The canonical SMILES for 6-(3-chloro-4-fluorophenyl)-N-(1,3-oxazol-2-yl)pyridine-2-carboxamide is O=C(Nc1ncco1)c1cccc(-c2ccc(F)c(Cl)c2)n1.
What is the InChIKey of 6-(3-chloro-4-fluorophenyl)-N-(1,3-oxazol-2-yl)pyridine-2-carboxamide?
The InChIKey is NWGRWYJFQVHHIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9ClFN3O2/c16-10-8-9(4-5-11(10)17)12-2-1-3-13(19-12)14(21)20-15-18-6-7-22-15/h1-8H,(H,18,20,21).
What are the key properties of 6-(3-chloro-4-fluorophenyl)-N-(1,3-oxazol-2-yl)pyridine-2-carboxamide?
6-(3-chloro-4-fluorophenyl)-N-(1,3-oxazol-2-yl)pyridine-2-carboxamide has a molecular weight of 317.71 g/mol, XLogP of 3.78, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-chloro-4-fluorophenyl)-N-(1,3-oxazol-2-yl)pyridine-2-carboxamide is sourced from PubChem (CID 162429839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).