5-(2-chlorophenyl)-3-(3-piperazin-1-ylphenyl)-1,3-oxazolidin-2-one

C19H20ClN3O2 — CID 90656172

IUPAC5-(2-chlorophenyl)-3-(3-piperazin-1-ylphenyl)-1,3-oxazolidin-2-one
SMILESO=C1OC(c2ccccc2Cl)CN1c1cccc(N2CCNCC2)c1
InChIInChI=1S/C19H20ClN3O2/c20-17-7-2-1-6-16(17)18-13-23(19(24)25-18)15-5-3-4-14(12-15)22-10-8-21-9-11-22/h1-7,12,18,21H,8-11,13H2
InChIKeyZQDZOAYNWRSFDS-UHFFFAOYSA-N
MW357.84 g/mol
LogP3.45
Rot. Bonds3

About 5-(2-chlorophenyl)-3-(3-piperazin-1-ylphenyl)-1,3-oxazolidin-2-one

5-(2-chlorophenyl)-3-(3-piperazin-1-ylphenyl)-1,3-oxazolidin-2-one (PubChem CID 90656172) has the molecular formula C19H20ClN3O2 and a molecular weight of 357.84 g/mol. Its IUPAC name is 5-(2-chlorophenyl)-3-(3-piperazin-1-ylphenyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name5-(2-chlorophenyl)-3-(3-piperazin-1-ylphenyl)-1,3-oxazolidin-2-one
PubChem CID90656172
Molecular FormulaC19H20ClN3O2
Molecular Weight357.84 g/mol
Exact Mass357.12
IUPAC Name5-(2-chlorophenyl)-3-(3-piperazin-1-ylphenyl)-1,3-oxazolidin-2-one
SMILESO=C1OC(c2ccccc2Cl)CN1c1cccc(N2CCNCC2)c1
InChIInChI=1S/C19H20ClN3O2/c20-17-7-2-1-6-16(17)18-13-23(19(24)25-18)15-5-3-4-14(12-15)22-10-8-21-9-11-22/h1-7,12,18,21H,8-11,13H2
InChIKeyZQDZOAYNWRSFDS-UHFFFAOYSA-N
XLogP3.45
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.84
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[4-(benzyloxy)piperidino]butyl-N-(4-chlorophenyl)carbamate
CID 10223679
[3-[4-(3-Chlorophenyl)piperazin-1-yl]-1-phenylpropyl] carbamate
CID 67281064
[3-[4-(4-Chlorophenyl)piperazin-1-yl]-1-phenylpropyl] carbamate
CID 67281893
5-(2-chlorophenyl)-3-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)-1,3-oxazolidin-2-one
CID 90656168
5-(3-chlorophenyl)-3-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)-1,3-oxazolidin-2-one
CID 90656170
5-(2-Chlorophenyl)-3-(1,2,3,4-tetrahydroisoquinolin-7-yl)-1,3-oxazolidin-2-one
CID 90656174
5-(2-Chlorophenyl)-3-(1,2,3,4-tetrahydroisoquinolin-6-yl)-1,3-oxazolidin-2-one
CID 90656175
5-(2-Chlorophenyl)-3-(4-piperazin-1-ylphenyl)-1,3-oxazolidin-2-one
CID 90656173
[1-(4-Chlorophenyl)-3-(4-phenylpiperazin-1-yl)propyl] carbamate
CID 25120347
[1-(3-Chlorophenyl)-3-(4-phenylpiperazin-1-yl)propyl] carbamate
CID 67281133
[3-[4-(2-Chlorophenyl)piperazin-1-yl]-1-phenylpropyl] carbamate
CID 67281479
1-(4-chlorophenyl)-2-(3,4-dihydroquinolin-1(2H)-yl)ethyl phenylcarbamate (6a)
CID 118986854

Frequently Asked Questions

What is the IUPAC name of 5-(2-chlorophenyl)-3-(3-piperazin-1-ylphenyl)-1,3-oxazolidin-2-one?
The IUPAC name of 5-(2-chlorophenyl)-3-(3-piperazin-1-ylphenyl)-1,3-oxazolidin-2-one (CID 90656172) is 5-(2-chlorophenyl)-3-(3-piperazin-1-ylphenyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for 5-(2-chlorophenyl)-3-(3-piperazin-1-ylphenyl)-1,3-oxazolidin-2-one?
The canonical SMILES for 5-(2-chlorophenyl)-3-(3-piperazin-1-ylphenyl)-1,3-oxazolidin-2-one is O=C1OC(c2ccccc2Cl)CN1c1cccc(N2CCNCC2)c1.
What is the InChIKey of 5-(2-chlorophenyl)-3-(3-piperazin-1-ylphenyl)-1,3-oxazolidin-2-one?
The InChIKey is ZQDZOAYNWRSFDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20ClN3O2/c20-17-7-2-1-6-16(17)18-13-23(19(24)25-18)15-5-3-4-14(12-15)22-10-8-21-9-11-22/h1-7,12,18,21H,8-11,13H2.
What are the key properties of 5-(2-chlorophenyl)-3-(3-piperazin-1-ylphenyl)-1,3-oxazolidin-2-one?
5-(2-chlorophenyl)-3-(3-piperazin-1-ylphenyl)-1,3-oxazolidin-2-one has a molecular weight of 357.84 g/mol, XLogP of 3.45, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-chlorophenyl)-3-(3-piperazin-1-ylphenyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 90656172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).