N-[[(5S)-2-oxo-3-[4-(2-oxopropyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide

C15H18N2O4 — CID 14011329

IUPACN-[[(5S)-2-oxo-3-[4-(2-oxopropyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide
SMILESCC(=O)Cc1ccc(N2C[C@H](CNC(C)=O)OC2=O)cc1
InChIInChI=1S/C15H18N2O4/c1-10(18)7-12-3-5-13(6-4-12)17-9-14(21-15(17)20)8-16-11(2)19/h3-6,14H,7-9H2,1-2H3,(H,16,19)/t14-/m0/s1
InChIKeyJEMLNXSEZBKLOB-AWEZNQCLSA-N
MW290.32 g/mol
LogP1.28
Rot. Bonds5

About N-[[(5S)-2-oxo-3-[4-(2-oxopropyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide

N-[[(5S)-2-oxo-3-[4-(2-oxopropyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide (PubChem CID 14011329) has the molecular formula C15H18N2O4 and a molecular weight of 290.32 g/mol. Its IUPAC name is N-[[(5S)-2-oxo-3-[4-(2-oxopropyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[(5S)-2-oxo-3-[4-(2-oxopropyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide
PubChem CID14011329
Molecular FormulaC15H18N2O4
Molecular Weight290.32 g/mol
Exact Mass290.13
IUPAC NameN-[[(5S)-2-oxo-3-[4-(2-oxopropyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide
SMILESCC(=O)Cc1ccc(N2C[C@H](CNC(C)=O)OC2=O)cc1
InChIInChI=1S/C15H18N2O4/c1-10(18)7-12-3-5-13(6-4-12)17-9-14(21-15(17)20)8-16-11(2)19/h3-6,14H,7-9H2,1-2H3,(H,16,19)/t14-/m0/s1
InChIKeyJEMLNXSEZBKLOB-AWEZNQCLSA-N
XLogP1.28
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[(5S)-2-oxo-3-[4-(2-oxopropyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide?
The IUPAC name of N-[[(5S)-2-oxo-3-[4-(2-oxopropyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide (CID 14011329) is N-[[(5S)-2-oxo-3-[4-(2-oxopropyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide.
What is the SMILES notation for N-[[(5S)-2-oxo-3-[4-(2-oxopropyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide?
The canonical SMILES for N-[[(5S)-2-oxo-3-[4-(2-oxopropyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide is CC(=O)Cc1ccc(N2C[C@H](CNC(C)=O)OC2=O)cc1.
What is the InChIKey of N-[[(5S)-2-oxo-3-[4-(2-oxopropyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide?
The InChIKey is JEMLNXSEZBKLOB-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H18N2O4/c1-10(18)7-12-3-5-13(6-4-12)17-9-14(21-15(17)20)8-16-11(2)19/h3-6,14H,7-9H2,1-2H3,(H,16,19)/t14-/m0/s1.
What are the key properties of N-[[(5S)-2-oxo-3-[4-(2-oxopropyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide?
N-[[(5S)-2-oxo-3-[4-(2-oxopropyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide has a molecular weight of 290.32 g/mol, XLogP of 1.28, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(5S)-2-oxo-3-[4-(2-oxopropyl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide is sourced from PubChem (CID 14011329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).