N-(4-fluoro-3-oxobutan-2-yl)-2-(4-methyl-2-oxo-1-phenyl-3-pyridinyl)butanamide

C20H23FN2O3 — CID 143668358

IUPACN-(4-fluoro-3-oxobutan-2-yl)-2-(4-methyl-2-oxo-1-phenyl-3-pyridinyl)butanamide
SMILESCCC(C(=O)NC(C)C(=O)CF)c1c(C)ccn(-c2ccccc2)c1=O
InChIInChI=1S/C20H23FN2O3/c1-4-16(19(25)22-14(3)17(24)12-21)18-13(2)10-11-23(20(18)26)15-8-6-5-7-9-15/h5-11,14,16H,4,12H2,1-3H3,(H,22,25)
InChIKeyRJAVIWMAYXROAJ-UHFFFAOYSA-N
MW358.41 g/mol
LogP2.68
Rot. Bonds7

About N-(4-fluoro-3-oxobutan-2-yl)-2-(4-methyl-2-oxo-1-phenyl-3-pyridinyl)butanamide

N-(4-fluoro-3-oxobutan-2-yl)-2-(4-methyl-2-oxo-1-phenyl-3-pyridinyl)butanamide (PubChem CID 143668358) has the molecular formula C20H23FN2O3 and a molecular weight of 358.41 g/mol. Its IUPAC name is N-(4-fluoro-3-oxobutan-2-yl)-2-(4-methyl-2-oxo-1-phenyl-3-pyridinyl)butanamide.

Molecular Properties

Compound NameN-(4-fluoro-3-oxobutan-2-yl)-2-(4-methyl-2-oxo-1-phenyl-3-pyridinyl)butanamide
PubChem CID143668358
Molecular FormulaC20H23FN2O3
Molecular Weight358.41 g/mol
Exact Mass358.17
IUPAC NameN-(4-fluoro-3-oxobutan-2-yl)-2-(4-methyl-2-oxo-1-phenyl-3-pyridinyl)butanamide
SMILESCCC(C(=O)NC(C)C(=O)CF)c1c(C)ccn(-c2ccccc2)c1=O
InChIInChI=1S/C20H23FN2O3/c1-4-16(19(25)22-14(3)17(24)12-21)18-13(2)10-11-23(20(18)26)15-8-6-5-7-9-15/h5-11,14,16H,4,12H2,1-3H3,(H,22,25)
InChIKeyRJAVIWMAYXROAJ-UHFFFAOYSA-N
XLogP2.68
TPSA68.17 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.41
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(4-fluoro-3-oxobutan-2-yl)-2-(4-methyl-2-oxo-1-phenyl-3-pyridinyl)butanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-methyl-2-oxo-1-phenyl-3-pyridinyl)butanoic acid
CID 68535624
5-fluoro-3-[2-[4-methyl-2-oxo-1-(2-phenylethenyl)-3-pyridinyl]butanoylamino]-4-oxopentanoic acid
CID 174599925
tert-butyl 5-fluoro-3-[2-(5-methyl-3-oxo-2-phenylpyridazin-4-yl)butanoylamino]-4-oxopentanoate
CID 86636498
methyl 2-(1-benzyl-4-methyl-2-oxo-3-pyridinyl)butanoate
CID 68540810
2-amino-N-[(2S)-4-fluoro-3-oxobutan-2-yl]-3-phenylpropanamide
CID 59684100
4-methyl-2-oxo-1-phenylpyridine-3-carboxamide
CID 175789879
4-[2-(2-benzyl-5-methyl-3-oxopyridazin-4-yl)hexanoylamino]-6-fluoro-2-methyl-5-oxohexanoic acid
CID 143620687
N-[1-(2,5-dimethylphenyl)ethyl]-2-phenylbutanamide
CID 17327188
2-[2-(4-fluorophenyl)butanoylamino]propanoic acid
CID 120523636
2-[2-[(3-bromophenyl)methyl]-3-oxopyridazin-4-yl]-N-(4-fluoro-3-oxobutan-2-yl)propanamide;ethane;ethanol
CID 143620685
3-(2-phenylbutanoylamino)butanoic acid
CID 43240651
2-[2,6-dimethyl-4-[(1-phenylpyrazol-3-yl)amino]phenyl]butanoic acid
CID 23174493

Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-3-oxobutan-2-yl)-2-(4-methyl-2-oxo-1-phenyl-3-pyridinyl)butanamide?
The IUPAC name of N-(4-fluoro-3-oxobutan-2-yl)-2-(4-methyl-2-oxo-1-phenyl-3-pyridinyl)butanamide (CID 143668358) is N-(4-fluoro-3-oxobutan-2-yl)-2-(4-methyl-2-oxo-1-phenyl-3-pyridinyl)butanamide.
What is the SMILES notation for N-(4-fluoro-3-oxobutan-2-yl)-2-(4-methyl-2-oxo-1-phenyl-3-pyridinyl)butanamide?
The canonical SMILES for N-(4-fluoro-3-oxobutan-2-yl)-2-(4-methyl-2-oxo-1-phenyl-3-pyridinyl)butanamide is CCC(C(=O)NC(C)C(=O)CF)c1c(C)ccn(-c2ccccc2)c1=O.
What is the InChIKey of N-(4-fluoro-3-oxobutan-2-yl)-2-(4-methyl-2-oxo-1-phenyl-3-pyridinyl)butanamide?
The InChIKey is RJAVIWMAYXROAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23FN2O3/c1-4-16(19(25)22-14(3)17(24)12-21)18-13(2)10-11-23(20(18)26)15-8-6-5-7-9-15/h5-11,14,16H,4,12H2,1-3H3,(H,22,25).
What are the key properties of N-(4-fluoro-3-oxobutan-2-yl)-2-(4-methyl-2-oxo-1-phenyl-3-pyridinyl)butanamide?
N-(4-fluoro-3-oxobutan-2-yl)-2-(4-methyl-2-oxo-1-phenyl-3-pyridinyl)butanamide has a molecular weight of 358.41 g/mol, XLogP of 2.68, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-3-oxobutan-2-yl)-2-(4-methyl-2-oxo-1-phenyl-3-pyridinyl)butanamide is sourced from PubChem (CID 143668358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).