1-butyl-2-hydroxy-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide

C11H13F3N2O3 — CID 150371565

IUPAC1-butyl-2-hydroxy-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide
SMILESCCCCn1c(O)c(C(N)=O)c(C(F)(F)F)cc1=O
InChIInChI=1S/C11H13F3N2O3/c1-2-3-4-16-7(17)5-6(11(12,13)14)8(9(15)18)10(16)19/h5,19H,2-4H2,1H3,(H2,15,18)
InChIKeyFUXOBPDGVPVCLB-UHFFFAOYSA-N
MW278.23 g/mol
LogP1.47
Rot. Bonds4

About 1-butyl-2-hydroxy-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide

1-butyl-2-hydroxy-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide (PubChem CID 150371565) has the molecular formula C11H13F3N2O3 and a molecular weight of 278.23 g/mol. Its IUPAC name is 1-butyl-2-hydroxy-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name1-butyl-2-hydroxy-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide
PubChem CID150371565
Molecular FormulaC11H13F3N2O3
Molecular Weight278.23 g/mol
Exact Mass278.09
IUPAC Name1-butyl-2-hydroxy-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide
SMILESCCCCn1c(O)c(C(N)=O)c(C(F)(F)F)cc1=O
InChIInChI=1S/C11H13F3N2O3/c1-2-3-4-16-7(17)5-6(11(12,13)14)8(9(15)18)10(16)19/h5,19H,2-4H2,1H3,(H2,15,18)
InChIKeyFUXOBPDGVPVCLB-UHFFFAOYSA-N
XLogP1.47
TPSA85.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.23
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-Pyridinecarboxamide, 1-ethyl-1,2-dihydro-6-hydroxy-4-methyl-2-oxo-
CID 120131
1-Methyl-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide
CID 137376349
4-(Difluoromethyl)-1-methyl-6-oxopyridine-3-carboxamide
CID 137377141
2-Hydroxy-1-methyl-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide
CID 139891630
1-Ethyl-2-hydroxy-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide
CID 139891635
1-Butyl-2-hydroxy-6-oxo-4-(trifluoromethyl)pyridine-3-carbonitrile
CID 140318541
2-Hydroxy-6-oxo-1-propyl-4-(trifluoromethyl)pyridine-3-carboxamide
CID 151636463
ST50979899
CID 572786
1-Ethyl-6-oxo-5-(trifluoromethyl)pyridine-3-carboxamide
CID 154465460
2-Hydroxy-4-methyl-1-(2-methylpropyl)-6-oxopyridine-3-carboxamide
CID 15131400
2-Hydroxy-4-methyl-6-oxo-1-propylpyridine-3-carboxamide
CID 15216538
1-Butyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide
CID 15216539

Frequently Asked Questions

What is the IUPAC name of 1-butyl-2-hydroxy-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide?
The IUPAC name of 1-butyl-2-hydroxy-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide (CID 150371565) is 1-butyl-2-hydroxy-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide.
What is the SMILES notation for 1-butyl-2-hydroxy-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide?
The canonical SMILES for 1-butyl-2-hydroxy-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide is CCCCn1c(O)c(C(N)=O)c(C(F)(F)F)cc1=O.
What is the InChIKey of 1-butyl-2-hydroxy-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide?
The InChIKey is FUXOBPDGVPVCLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F3N2O3/c1-2-3-4-16-7(17)5-6(11(12,13)14)8(9(15)18)10(16)19/h5,19H,2-4H2,1H3,(H2,15,18).
What are the key properties of 1-butyl-2-hydroxy-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide?
1-butyl-2-hydroxy-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide has a molecular weight of 278.23 g/mol, XLogP of 1.47, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butyl-2-hydroxy-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide is sourced from PubChem (CID 150371565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).