N-[3-[5-(anilinomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]benzamide

C23H21N3O3 — CID 11409453

IUPACN-[3-[5-(anilinomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]benzamide
SMILESO=C(Nc1cccc(N2CC(CNc3ccccc3)OC2=O)c1)c1ccccc1
InChIInChI=1S/C23H21N3O3/c27-22(17-8-3-1-4-9-17)25-19-12-7-13-20(14-19)26-16-21(29-23(26)28)15-24-18-10-5-2-6-11-18/h1-14,21,24H,15-16H2,(H,25,27)
InChIKeyYIKRPWSYFXGPKH-UHFFFAOYSA-N
MW387.44 g/mol
LogP4.38
Rot. Bonds6

About N-[3-[5-(anilinomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]benzamide

N-[3-[5-(anilinomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]benzamide (PubChem CID 11409453) has the molecular formula C23H21N3O3 and a molecular weight of 387.44 g/mol. Its IUPAC name is N-[3-[5-(anilinomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]benzamide.

Molecular Properties

Compound NameN-[3-[5-(anilinomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]benzamide
PubChem CID11409453
Molecular FormulaC23H21N3O3
Molecular Weight387.44 g/mol
Exact Mass387.16
IUPAC NameN-[3-[5-(anilinomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]benzamide
SMILESO=C(Nc1cccc(N2CC(CNc3ccccc3)OC2=O)c1)c1ccccc1
InChIInChI=1S/C23H21N3O3/c27-22(17-8-3-1-4-9-17)25-19-12-7-13-20(14-19)26-16-21(29-23(26)28)15-24-18-10-5-2-6-11-18/h1-14,21,24H,15-16H2,(H,25,27)
InChIKeyYIKRPWSYFXGPKH-UHFFFAOYSA-N
XLogP4.38
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.44
LogP ≤ 54.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[2-oxo-3-[3-(trifluoromethyl)phenyl]-1,3-oxazolidin-5-yl]methyl]benzamide
CID 110328384
1-[[3-(3-fluorophenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-3-phenylurea
CID 110327677
3-fluoro-N-[(2-oxo-3-phenyl-1,3-oxazolidin-5-yl)methyl]benzamide
CID 16920440
N-[3-[(1S,2S,6R,7R)-3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl]phenyl]benzamide
CID 1216930
N-[3-[(1S,2S,6S,7S)-3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl]phenyl]benzamide
CID 23306487
N-[3-[(1S,2R,6S,7R)-3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl]phenyl]benzamide
CID 7117751
N-[[3-(3-chlorophenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-4-methylbenzamide
CID 16921024
N-[[(5S)-3-(3-chlorophenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-3-fluorobenzamide
CID 40926357
4-benzamido-N-[3-(2-oxoimidazolidin-1-yl)phenyl]benzamide
CID 55726264
1-(4-chlorophenyl)-3-[(2-oxo-3-phenyl-1,3-oxazolidin-5-yl)methyl]urea
CID 16922883
N-[[3-(3-chlorophenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-2-methylbenzamide
CID 16921022
N-[[3-(3-chlorophenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-3-methoxybenzamide
CID 16921029

Frequently Asked Questions

What is the IUPAC name of N-[3-[5-(anilinomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]benzamide?
The IUPAC name of N-[3-[5-(anilinomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]benzamide (CID 11409453) is N-[3-[5-(anilinomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]benzamide.
What is the SMILES notation for N-[3-[5-(anilinomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]benzamide?
The canonical SMILES for N-[3-[5-(anilinomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]benzamide is O=C(Nc1cccc(N2CC(CNc3ccccc3)OC2=O)c1)c1ccccc1.
What is the InChIKey of N-[3-[5-(anilinomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]benzamide?
The InChIKey is YIKRPWSYFXGPKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3O3/c27-22(17-8-3-1-4-9-17)25-19-12-7-13-20(14-19)26-16-21(29-23(26)28)15-24-18-10-5-2-6-11-18/h1-14,21,24H,15-16H2,(H,25,27).
What are the key properties of N-[3-[5-(anilinomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]benzamide?
N-[3-[5-(anilinomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]benzamide has a molecular weight of 387.44 g/mol, XLogP of 4.38, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[5-(anilinomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]benzamide is sourced from PubChem (CID 11409453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).