N-[4-[5-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-3-yl]-2-hydroxy-1-bicyclo[2.2.2]octanyl]acetamide

C19H23ClN2O4 — CID 155093030

IUPACN-[4-[5-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-3-yl]-2-hydroxy-1-bicyclo[2.2.2]octanyl]acetamide
SMILESCC(=O)NC12CCC(N3CC(c4ccc(Cl)cc4)OC3=O)(CC1)CC2O
InChIInChI=1S/C19H23ClN2O4/c1-12(23)21-19-8-6-18(7-9-19,10-16(19)24)22-11-15(26-17(22)25)13-2-4-14(20)5-3-13/h2-5,15-16,24H,6-11H2,1H3,(H,21,23)
InChIKeyZEUZZDDQTCHRMA-UHFFFAOYSA-N
MW378.86 g/mol
LogP2.79
Rot. Bonds3

About N-[4-[5-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-3-yl]-2-hydroxy-1-bicyclo[2.2.2]octanyl]acetamide

N-[4-[5-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-3-yl]-2-hydroxy-1-bicyclo[2.2.2]octanyl]acetamide (PubChem CID 155093030) has the molecular formula C19H23ClN2O4 and a molecular weight of 378.86 g/mol. Its IUPAC name is N-[4-[5-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-3-yl]-2-hydroxy-1-bicyclo[2.2.2]octanyl]acetamide.

Molecular Properties

Compound NameN-[4-[5-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-3-yl]-2-hydroxy-1-bicyclo[2.2.2]octanyl]acetamide
PubChem CID155093030
Molecular FormulaC19H23ClN2O4
Molecular Weight378.86 g/mol
Exact Mass378.13
IUPAC NameN-[4-[5-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-3-yl]-2-hydroxy-1-bicyclo[2.2.2]octanyl]acetamide
SMILESCC(=O)NC12CCC(N3CC(c4ccc(Cl)cc4)OC3=O)(CC1)CC2O
InChIInChI=1S/C19H23ClN2O4/c1-12(23)21-19-8-6-18(7-9-19,10-16(19)24)22-11-15(26-17(22)25)13-2-4-14(20)5-3-13/h2-5,15-16,24H,6-11H2,1H3,(H,21,23)
InChIKeyZEUZZDDQTCHRMA-UHFFFAOYSA-N
XLogP2.79
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.86
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[4-[5-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-3-yl]-2-hydroxy-1-bicyclo[2.2.2]octanyl]acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[4-[5-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-3-yl]-2-hydroxy-1-bicyclo[2.2.2]octanyl]acetamide?
The IUPAC name of N-[4-[5-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-3-yl]-2-hydroxy-1-bicyclo[2.2.2]octanyl]acetamide (CID 155093030) is N-[4-[5-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-3-yl]-2-hydroxy-1-bicyclo[2.2.2]octanyl]acetamide.
What is the SMILES notation for N-[4-[5-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-3-yl]-2-hydroxy-1-bicyclo[2.2.2]octanyl]acetamide?
The canonical SMILES for N-[4-[5-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-3-yl]-2-hydroxy-1-bicyclo[2.2.2]octanyl]acetamide is CC(=O)NC12CCC(N3CC(c4ccc(Cl)cc4)OC3=O)(CC1)CC2O.
What is the InChIKey of N-[4-[5-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-3-yl]-2-hydroxy-1-bicyclo[2.2.2]octanyl]acetamide?
The InChIKey is ZEUZZDDQTCHRMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23ClN2O4/c1-12(23)21-19-8-6-18(7-9-19,10-16(19)24)22-11-15(26-17(22)25)13-2-4-14(20)5-3-13/h2-5,15-16,24H,6-11H2,1H3,(H,21,23).
What are the key properties of N-[4-[5-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-3-yl]-2-hydroxy-1-bicyclo[2.2.2]octanyl]acetamide?
N-[4-[5-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-3-yl]-2-hydroxy-1-bicyclo[2.2.2]octanyl]acetamide has a molecular weight of 378.86 g/mol, XLogP of 2.79, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[5-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-3-yl]-2-hydroxy-1-bicyclo[2.2.2]octanyl]acetamide is sourced from PubChem (CID 155093030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).