N-[2-(2-fluorophenoxy)propyl]-1-methyl-2-oxopyridine-4-carboxamide

C16H17FN2O3 — CID 71994313

IUPACN-[2-(2-fluorophenoxy)propyl]-1-methyl-2-oxopyridine-4-carboxamide
SMILESCC(CNC(=O)c1ccn(C)c(=O)c1)Oc1ccccc1F
InChIInChI=1S/C16H17FN2O3/c1-11(22-14-6-4-3-5-13(14)17)10-18-16(21)12-7-8-19(2)15(20)9-12/h3-9,11H,10H2,1-2H3,(H,18,21)
InChIKeyUVGAHUDROIWDIQ-UHFFFAOYSA-N
MW304.32 g/mol
LogP1.72
Rot. Bonds5

About N-[2-(2-fluorophenoxy)propyl]-1-methyl-2-oxopyridine-4-carboxamide

N-[2-(2-fluorophenoxy)propyl]-1-methyl-2-oxopyridine-4-carboxamide (PubChem CID 71994313) has the molecular formula C16H17FN2O3 and a molecular weight of 304.32 g/mol. Its IUPAC name is N-[2-(2-fluorophenoxy)propyl]-1-methyl-2-oxopyridine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(2-fluorophenoxy)propyl]-1-methyl-2-oxopyridine-4-carboxamide
PubChem CID71994313
Molecular FormulaC16H17FN2O3
Molecular Weight304.32 g/mol
Exact Mass304.12
IUPAC NameN-[2-(2-fluorophenoxy)propyl]-1-methyl-2-oxopyridine-4-carboxamide
SMILESCC(CNC(=O)c1ccn(C)c(=O)c1)Oc1ccccc1F
InChIInChI=1S/C16H17FN2O3/c1-11(22-14-6-4-3-5-13(14)17)10-18-16(21)12-7-8-19(2)15(20)9-12/h3-9,11H,10H2,1-2H3,(H,18,21)
InChIKeyUVGAHUDROIWDIQ-UHFFFAOYSA-N
XLogP1.72
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.32
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-ethylbutyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 113232055
1-methyl-N-(3-methyl-2-oxobutyl)-2-oxopyridine-4-carboxamide
CID 104860744
2-bromo-N-[2-(2-fluorophenoxy)propyl]-6-methylpyridine-3-carboxamide
CID 71909521
N-[2-(2,2-difluoroethoxy)ethyl]-1-methyl-2-oxopyridine-4-carboxamide
CID 103082580
1-methyl-N-[(2R)-2-(3-methylphenoxy)butyl]-2-oxopyridine-4-carboxamide
CID 96529043
1-methyl-N-[(2S)-2-(3-methylphenoxy)butyl]-2-oxopyridine-4-carboxamide
CID 96529042
3-[[(1-methyl-2-oxopyridine-4-carbonyl)amino]methyl]pentanoic acid
CID 81065047
N-[(4-fluoro-3,5-dimethylphenyl)methyl]-1-methyl-2-oxopyridine-4-carboxamide
CID 103747290
N-butyl-1-methyl-2-oxopyridine-4-carboxamide
CID 35555679
N-(4-bromo-2-ethylbutyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 114039929
1-[2-(2-fluorophenoxy)propyl]-3-(3-hydroxypropyl)urea
CID 111508672
N-[(3-fluorophenyl)methyl]-1-methyl-2-oxopyridine-4-carboxamide
CID 103612084

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluorophenoxy)propyl]-1-methyl-2-oxopyridine-4-carboxamide?
The IUPAC name of N-[2-(2-fluorophenoxy)propyl]-1-methyl-2-oxopyridine-4-carboxamide (CID 71994313) is N-[2-(2-fluorophenoxy)propyl]-1-methyl-2-oxopyridine-4-carboxamide.
What is the SMILES notation for N-[2-(2-fluorophenoxy)propyl]-1-methyl-2-oxopyridine-4-carboxamide?
The canonical SMILES for N-[2-(2-fluorophenoxy)propyl]-1-methyl-2-oxopyridine-4-carboxamide is CC(CNC(=O)c1ccn(C)c(=O)c1)Oc1ccccc1F.
What is the InChIKey of N-[2-(2-fluorophenoxy)propyl]-1-methyl-2-oxopyridine-4-carboxamide?
The InChIKey is UVGAHUDROIWDIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O3/c1-11(22-14-6-4-3-5-13(14)17)10-18-16(21)12-7-8-19(2)15(20)9-12/h3-9,11H,10H2,1-2H3,(H,18,21).
What are the key properties of N-[2-(2-fluorophenoxy)propyl]-1-methyl-2-oxopyridine-4-carboxamide?
N-[2-(2-fluorophenoxy)propyl]-1-methyl-2-oxopyridine-4-carboxamide has a molecular weight of 304.32 g/mol, XLogP of 1.72, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluorophenoxy)propyl]-1-methyl-2-oxopyridine-4-carboxamide is sourced from PubChem (CID 71994313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).