3-(3-oxo-1,3-diphenylpropyl)-1,3-oxazolidin-2-one

C18H17NO3 — CID 11403687

IUPAC3-(3-oxo-1,3-diphenylpropyl)-1,3-oxazolidin-2-one
SMILESO=C(CC(c1ccccc1)N1CCOC1=O)c1ccccc1
InChIInChI=1S/C18H17NO3/c20-17(15-9-5-2-6-10-15)13-16(14-7-3-1-4-8-14)19-11-12-22-18(19)21/h1-10,16H,11-13H2
InChIKeyCFZFPXREMWXYKB-UHFFFAOYSA-N
MW295.34 g/mol
LogP3.45
Rot. Bonds5

About 3-(3-oxo-1,3-diphenylpropyl)-1,3-oxazolidin-2-one

3-(3-oxo-1,3-diphenylpropyl)-1,3-oxazolidin-2-one (PubChem CID 11403687) has the molecular formula C18H17NO3 and a molecular weight of 295.34 g/mol. Its IUPAC name is 3-(3-oxo-1,3-diphenylpropyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-(3-oxo-1,3-diphenylpropyl)-1,3-oxazolidin-2-one
PubChem CID11403687
Molecular FormulaC18H17NO3
Molecular Weight295.34 g/mol
Exact Mass295.12
IUPAC Name3-(3-oxo-1,3-diphenylpropyl)-1,3-oxazolidin-2-one
SMILESO=C(CC(c1ccccc1)N1CCOC1=O)c1ccccc1
InChIInChI=1S/C18H17NO3/c20-17(15-9-5-2-6-10-15)13-16(14-7-3-1-4-8-14)19-11-12-22-18(19)21/h1-10,16H,11-13H2
InChIKeyCFZFPXREMWXYKB-UHFFFAOYSA-N
XLogP3.45
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-3-[4-[(1R)-3-oxo-1,3-diphenylpropyl]piperazin-1-yl]-1,3-diphenylpropan-1-one
CID 51617866
(E)-but-2-enedioic acid;3-(3-morpholin-4-yl-1-phenylpropyl)-1,3-oxazolidin-2-one
CID 67623511
3-[(3R)-4-methyl-3-phenylpentanoyl]-1,3-oxazolidin-2-one
CID 11139889
3-[3-oxo-1-phenyl-3-(1,4,8-triazatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-8-yl)propyl]-1,3-oxazolidin-2-one
CID 154854891
3-phenacyl-1,5-diphenylpentane-1,5-dione
CID 10547136
2-naphthalen-2-yl-2-(2-oxo-1,3-oxazolidin-3-yl)acetic acid
CID 19849098
(3R)-1,3-diphenyl-3-(1,2,4-triazol-1-yl)propan-1-one
CID 40573311
1-[[3-[[3-(2-oxo-1,3-oxazolidin-3-yl)-3-phenylpropanoyl]amino]phenyl]methyl]piperidine-3-carboxamide
CID 166190550
(3S)-1,3-diphenyl-3-(3-phenylpyrazol-1-yl)propan-1-one
CID 139190876
(2S)-4-oxo-2,4-diphenylbutanoic acid
CID 6950859
3-[4-(dimethylamino)phenyl]-1-phenyl-3-piperidin-1-ylpropan-1-one
CID 71324369
(3S)-1-(4-fluorophenyl)-3-phenyl-3-(4-phenylpiperazin-1-yl)propan-1-one
CID 27153354

Frequently Asked Questions

What is the IUPAC name of 3-(3-oxo-1,3-diphenylpropyl)-1,3-oxazolidin-2-one?
The IUPAC name of 3-(3-oxo-1,3-diphenylpropyl)-1,3-oxazolidin-2-one (CID 11403687) is 3-(3-oxo-1,3-diphenylpropyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-(3-oxo-1,3-diphenylpropyl)-1,3-oxazolidin-2-one?
The canonical SMILES for 3-(3-oxo-1,3-diphenylpropyl)-1,3-oxazolidin-2-one is O=C(CC(c1ccccc1)N1CCOC1=O)c1ccccc1.
What is the InChIKey of 3-(3-oxo-1,3-diphenylpropyl)-1,3-oxazolidin-2-one?
The InChIKey is CFZFPXREMWXYKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NO3/c20-17(15-9-5-2-6-10-15)13-16(14-7-3-1-4-8-14)19-11-12-22-18(19)21/h1-10,16H,11-13H2.
What are the key properties of 3-(3-oxo-1,3-diphenylpropyl)-1,3-oxazolidin-2-one?
3-(3-oxo-1,3-diphenylpropyl)-1,3-oxazolidin-2-one has a molecular weight of 295.34 g/mol, XLogP of 3.45, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-oxo-1,3-diphenylpropyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 11403687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).