N-[4-fluoro-2-[4-(2-oxo-4-propan-2-yl-1,3-oxazolidin-3-yl)piperidine-1-carbonyl]phenyl]acetamide

C20H26FN3O4 — CID 3732319

IUPACN-[4-fluoro-2-[4-(2-oxo-4-propan-2-yl-1,3-oxazolidin-3-yl)piperidine-1-carbonyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(F)cc1C(=O)N1CCC(N2C(=O)OCC2C(C)C)CC1
InChIInChI=1S/C20H26FN3O4/c1-12(2)18-11-28-20(27)24(18)15-6-8-23(9-7-15)19(26)16-10-14(21)4-5-17(16)22-13(3)25/h4-5,10,12,15,18H,6-9,11H2,1-3H3,(H,22,25)
InChIKeyRJKRJLCRAXBVDF-UHFFFAOYSA-N
MW391.44 g/mol
LogP2.87
Rot. Bonds4

About N-[4-fluoro-2-[4-(2-oxo-4-propan-2-yl-1,3-oxazolidin-3-yl)piperidine-1-carbonyl]phenyl]acetamide

N-[4-fluoro-2-[4-(2-oxo-4-propan-2-yl-1,3-oxazolidin-3-yl)piperidine-1-carbonyl]phenyl]acetamide (PubChem CID 3732319) has the molecular formula C20H26FN3O4 and a molecular weight of 391.44 g/mol. Its IUPAC name is N-[4-fluoro-2-[4-(2-oxo-4-propan-2-yl-1,3-oxazolidin-3-yl)piperidine-1-carbonyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-fluoro-2-[4-(2-oxo-4-propan-2-yl-1,3-oxazolidin-3-yl)piperidine-1-carbonyl]phenyl]acetamide
PubChem CID3732319
Molecular FormulaC20H26FN3O4
Molecular Weight391.44 g/mol
Exact Mass391.19
IUPAC NameN-[4-fluoro-2-[4-(2-oxo-4-propan-2-yl-1,3-oxazolidin-3-yl)piperidine-1-carbonyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(F)cc1C(=O)N1CCC(N2C(=O)OCC2C(C)C)CC1
InChIInChI=1S/C20H26FN3O4/c1-12(2)18-11-28-20(27)24(18)15-6-8-23(9-7-15)19(26)16-10-14(21)4-5-17(16)22-13(3)25/h4-5,10,12,15,18H,6-9,11H2,1-3H3,(H,22,25)
InChIKeyRJKRJLCRAXBVDF-UHFFFAOYSA-N
XLogP2.87
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.44
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-Amino-N-[3-(morpholin-4-yl)propyl]benzamide
CID 2306528
2-(Morpholine-4-carbonyl)aniline
CID 726276
2-[(2-fluorobenzoyl)amino]-N-(2-morpholin-4-ylethyl)benzamide
CID 24824960
Ethyl 4-{[2-(acetylamino)phenyl]carbonyl}piperazine-1-carboxylate
CID 742027
N-[2-(4-morpholinylcarbonyl)phenyl]-3-phenylpropanamide
CID 2206381
2-benzamido-N-(3-morpholin-4-ylpropyl)benzamide
CID 2812678
2-[(4-fluorobenzoyl)amino]-N-(3-morpholinopropyl)benzamide
CID 2812996
1-isopropyl-N-{2-[(methylamino)carbonyl]phenyl}-5-oxo-3-pyrrolidinecarboxamide
CID 6459465
N-{2-[(ethylamino)carbonyl]phenyl}-1-isopropyl-5-oxo-3-pyrrolidinecarboxamide
CID 6493104
1-Isopropyl-5-oxo-pyrrolidine-3-carboxylic acid (2-allylcarbamoyl-phenyl)-amide
CID 6493112
N-[2-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-4-methylbenzamide
CID 577309
Butyl 2-(4-morpholinylcarbonyl)phenylcarbamate
CID 2175702

Frequently Asked Questions

What is the IUPAC name of N-[4-fluoro-2-[4-(2-oxo-4-propan-2-yl-1,3-oxazolidin-3-yl)piperidine-1-carbonyl]phenyl]acetamide?
The IUPAC name of N-[4-fluoro-2-[4-(2-oxo-4-propan-2-yl-1,3-oxazolidin-3-yl)piperidine-1-carbonyl]phenyl]acetamide (CID 3732319) is N-[4-fluoro-2-[4-(2-oxo-4-propan-2-yl-1,3-oxazolidin-3-yl)piperidine-1-carbonyl]phenyl]acetamide.
What is the SMILES notation for N-[4-fluoro-2-[4-(2-oxo-4-propan-2-yl-1,3-oxazolidin-3-yl)piperidine-1-carbonyl]phenyl]acetamide?
The canonical SMILES for N-[4-fluoro-2-[4-(2-oxo-4-propan-2-yl-1,3-oxazolidin-3-yl)piperidine-1-carbonyl]phenyl]acetamide is CC(=O)Nc1ccc(F)cc1C(=O)N1CCC(N2C(=O)OCC2C(C)C)CC1.
What is the InChIKey of N-[4-fluoro-2-[4-(2-oxo-4-propan-2-yl-1,3-oxazolidin-3-yl)piperidine-1-carbonyl]phenyl]acetamide?
The InChIKey is RJKRJLCRAXBVDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26FN3O4/c1-12(2)18-11-28-20(27)24(18)15-6-8-23(9-7-15)19(26)16-10-14(21)4-5-17(16)22-13(3)25/h4-5,10,12,15,18H,6-9,11H2,1-3H3,(H,22,25).
What are the key properties of N-[4-fluoro-2-[4-(2-oxo-4-propan-2-yl-1,3-oxazolidin-3-yl)piperidine-1-carbonyl]phenyl]acetamide?
N-[4-fluoro-2-[4-(2-oxo-4-propan-2-yl-1,3-oxazolidin-3-yl)piperidine-1-carbonyl]phenyl]acetamide has a molecular weight of 391.44 g/mol, XLogP of 2.87, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-fluoro-2-[4-(2-oxo-4-propan-2-yl-1,3-oxazolidin-3-yl)piperidine-1-carbonyl]phenyl]acetamide is sourced from PubChem (CID 3732319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).