N-(4-fluorophenyl)-1-[2-[[2-(3-fluorophenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide

C24H23F2N3O3 — CID 92635170

IUPACN-(4-fluorophenyl)-1-[2-[[2-(3-fluorophenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide
SMILESCC(C)(CNC(=O)Cn1cccc(C(=O)Nc2ccc(F)cc2)c1=O)c1cccc(F)c1
InChIInChI=1S/C24H23F2N3O3/c1-24(2,16-5-3-6-18(26)13-16)15-27-21(30)14-29-12-4-7-20(23(29)32)22(31)28-19-10-8-17(25)9-11-19/h3-13H,14-15H2,1-2H3,(H,27,30)(H,28,31)
InChIKeyYXMXOOJFEAUQIE-UHFFFAOYSA-N
MW439.46 g/mol
LogP3.47
Rot. Bonds7

About N-(4-fluorophenyl)-1-[2-[[2-(3-fluorophenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide

N-(4-fluorophenyl)-1-[2-[[2-(3-fluorophenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide (PubChem CID 92635170) has the molecular formula C24H23F2N3O3 and a molecular weight of 439.46 g/mol. Its IUPAC name is N-(4-fluorophenyl)-1-[2-[[2-(3-fluorophenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-1-[2-[[2-(3-fluorophenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide
PubChem CID92635170
Molecular FormulaC24H23F2N3O3
Molecular Weight439.46 g/mol
Exact Mass439.17
IUPAC NameN-(4-fluorophenyl)-1-[2-[[2-(3-fluorophenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide
SMILESCC(C)(CNC(=O)Cn1cccc(C(=O)Nc2ccc(F)cc2)c1=O)c1cccc(F)c1
InChIInChI=1S/C24H23F2N3O3/c1-24(2,16-5-3-6-18(26)13-16)15-27-21(30)14-29-12-4-7-20(23(29)32)22(31)28-19-10-8-17(25)9-11-19/h3-13H,14-15H2,1-2H3,(H,27,30)(H,28,31)
InChIKeyYXMXOOJFEAUQIE-UHFFFAOYSA-N
XLogP3.47
TPSA80.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500439.46
LogP ≤ 53.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-fluorophenyl)-1-[2-[2-(3-methylphenyl)ethylamino]-2-oxoethyl]-2-oxopyridine-3-carboxamide
CID 92635156
N-(4-fluorophenyl)-2-oxo-1-[2-oxo-2-[[(1S)-1-pyridin-2-ylethyl]amino]ethyl]pyridine-3-carboxamide
CID 92635470
N-[2-(3-fluorophenyl)-2-methylpropyl]-2-(methylamino)acetamide
CID 115152192
methyl 4-[[1-[(3-fluorophenyl)methyl]-2-oxopyridine-3-carbonyl]amino]benzoate
CID 7597576
N-(4-fluorophenyl)-1-[(4-methylphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 7598726
N-(4-acetamidophenyl)-2-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]pyridine-3-carboxamide
CID 26843705
2-(4-aminophenyl)-N-[2-(3-fluorophenyl)-2-methylpropyl]acetamide
CID 119796104
N-[2-(3-fluorophenyl)-2-methylpropyl]carbamoyl bromide
CID 115194299
[2-(3-fluorophenyl)-2-methylpropyl]urea
CID 115168840
1-[(4-chlorophenyl)methyl]-N-(4-fluorophenyl)-2-oxopyridine-3-carboxamide
CID 7598014
N-[2-(3-fluorophenyl)-2-methylpropyl]-2-methyl-3-oxo-1H-pyrazole-5-carboxamide
CID 138034558
N-cyclopentyl-1-[2-[[2-(2-fluorophenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide
CID 92632183

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-1-[2-[[2-(3-fluorophenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide?
The IUPAC name of N-(4-fluorophenyl)-1-[2-[[2-(3-fluorophenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide (CID 92635170) is N-(4-fluorophenyl)-1-[2-[[2-(3-fluorophenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide.
What is the SMILES notation for N-(4-fluorophenyl)-1-[2-[[2-(3-fluorophenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide?
The canonical SMILES for N-(4-fluorophenyl)-1-[2-[[2-(3-fluorophenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide is CC(C)(CNC(=O)Cn1cccc(C(=O)Nc2ccc(F)cc2)c1=O)c1cccc(F)c1.
What is the InChIKey of N-(4-fluorophenyl)-1-[2-[[2-(3-fluorophenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide?
The InChIKey is YXMXOOJFEAUQIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23F2N3O3/c1-24(2,16-5-3-6-18(26)13-16)15-27-21(30)14-29-12-4-7-20(23(29)32)22(31)28-19-10-8-17(25)9-11-19/h3-13H,14-15H2,1-2H3,(H,27,30)(H,28,31).
What are the key properties of N-(4-fluorophenyl)-1-[2-[[2-(3-fluorophenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide?
N-(4-fluorophenyl)-1-[2-[[2-(3-fluorophenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide has a molecular weight of 439.46 g/mol, XLogP of 3.47, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-1-[2-[[2-(3-fluorophenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 92635170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).