N-hydroxy-N,3-dimethyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide

C18H15F3N4O3 — CID 155585099

IUPACN-hydroxy-N,3-dimethyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide
SMILESCc1cc(Nc2ncc(-c3ccc(C(F)(F)F)cc3)o2)cnc1C(=O)N(C)O
InChIInChI=1S/C18H15F3N4O3/c1-10-7-13(8-22-15(10)16(26)25(2)27)24-17-23-9-14(28-17)11-3-5-12(6-4-11)18(19,20)21/h3-9,27H,1-2H3,(H,23,24)
InChIKeyOHBNEYFXTAZVKL-UHFFFAOYSA-N
MW392.34 g/mol
LogP4.27
Rot. Bonds4

About N-hydroxy-N,3-dimethyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide

N-hydroxy-N,3-dimethyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide (PubChem CID 155585099) has the molecular formula C18H15F3N4O3 and a molecular weight of 392.34 g/mol. Its IUPAC name is N-hydroxy-N,3-dimethyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-hydroxy-N,3-dimethyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide
PubChem CID155585099
Molecular FormulaC18H15F3N4O3
Molecular Weight392.34 g/mol
Exact Mass392.11
IUPAC NameN-hydroxy-N,3-dimethyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide
SMILESCc1cc(Nc2ncc(-c3ccc(C(F)(F)F)cc3)o2)cnc1C(=O)N(C)O
InChIInChI=1S/C18H15F3N4O3/c1-10-7-13(8-22-15(10)16(26)25(2)27)24-17-23-9-14(28-17)11-3-5-12(6-4-11)18(19,20)21/h3-9,27H,1-2H3,(H,23,24)
InChIKeyOHBNEYFXTAZVKL-UHFFFAOYSA-N
XLogP4.27
TPSA91.49 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.34
LogP ≤ 54.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-hydroxy-N,3-dimethyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide?
The IUPAC name of N-hydroxy-N,3-dimethyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide (CID 155585099) is N-hydroxy-N,3-dimethyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide.
What is the SMILES notation for N-hydroxy-N,3-dimethyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide?
The canonical SMILES for N-hydroxy-N,3-dimethyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide is Cc1cc(Nc2ncc(-c3ccc(C(F)(F)F)cc3)o2)cnc1C(=O)N(C)O.
What is the InChIKey of N-hydroxy-N,3-dimethyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide?
The InChIKey is OHBNEYFXTAZVKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15F3N4O3/c1-10-7-13(8-22-15(10)16(26)25(2)27)24-17-23-9-14(28-17)11-3-5-12(6-4-11)18(19,20)21/h3-9,27H,1-2H3,(H,23,24).
What are the key properties of N-hydroxy-N,3-dimethyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide?
N-hydroxy-N,3-dimethyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide has a molecular weight of 392.34 g/mol, XLogP of 4.27, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-N,3-dimethyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide is sourced from PubChem (CID 155585099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).