(3R,5R)-3-amino-5-phenyloxolan-2-one

C10H11NO2 — CID 12521195

IUPAC(3R,5R)-3-amino-5-phenyloxolan-2-one
SMILESN[C@@H]1C[C@H](c2ccccc2)OC1=O
InChIInChI=1S/C10H11NO2/c11-8-6-9(13-10(8)12)7-4-2-1-3-5-7/h1-5,8-9H,6,11H2/t8-,9-/m1/s1
InChIKeyODKXNQYXRPVRAR-RKDXNWHRSA-N
MW177.20 g/mol
LogP1.00
Rot. Bonds1

About (3R,5R)-3-amino-5-phenyloxolan-2-one

(3R,5R)-3-amino-5-phenyloxolan-2-one (PubChem CID 12521195) has the molecular formula C10H11NO2 and a molecular weight of 177.20 g/mol. Its IUPAC name is (3R,5R)-3-amino-5-phenyloxolan-2-one.

Molecular Properties

Compound Name(3R,5R)-3-amino-5-phenyloxolan-2-one
PubChem CID12521195
Molecular FormulaC10H11NO2
Molecular Weight177.20 g/mol
Exact Mass177.08
IUPAC Name(3R,5R)-3-amino-5-phenyloxolan-2-one
SMILESN[C@@H]1C[C@H](c2ccccc2)OC1=O
InChIInChI=1S/C10H11NO2/c11-8-6-9(13-10(8)12)7-4-2-1-3-5-7/h1-5,8-9H,6,11H2/t8-,9-/m1/s1
InChIKeyODKXNQYXRPVRAR-RKDXNWHRSA-N
XLogP1.00
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.20
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-5-(4-bromophenyl)oxolan-2-one
CID 82159789
(3S)-3-hydroxy-5-phenyloxolan-2-one
CID 46197935
3-chloro-5-phenyloxolan-2-one
CID 3018341
(3R,5R)-3-hydroxy-5-phenyloxolan-2-one
CID 11665488
(3R,5R)-3-ethenyl-5-phenyloxolan-2-one
CID 71408121
3-amino-5-(2,3-dihydro-1H-inden-5-yl)oxolan-2-one
CID 82158557
(3S,5S)-3-azido-5-phenyloxolan-2-one
CID 102451787
methyl (5S)-2-oxo-5-phenyloxolane-3-carboxylate
CID 102111765
4,6-diphenyloxan-2-one
CID 78061466
(3S,5R)-5-phenyl-3-[(Z)-4-phenylmethoxybut-2-enyl]oxolan-2-one
CID 59568811
N-[(3S,5S)-2-oxo-5-phenyloxolan-3-yl]benzamide
CID 102525266
2,6-diphenyloxan-4-one
CID 500287

Frequently Asked Questions

What is the IUPAC name of (3R,5R)-3-amino-5-phenyloxolan-2-one?
The IUPAC name of (3R,5R)-3-amino-5-phenyloxolan-2-one (CID 12521195) is (3R,5R)-3-amino-5-phenyloxolan-2-one.
What is the SMILES notation for (3R,5R)-3-amino-5-phenyloxolan-2-one?
The canonical SMILES for (3R,5R)-3-amino-5-phenyloxolan-2-one is N[C@@H]1C[C@H](c2ccccc2)OC1=O.
What is the InChIKey of (3R,5R)-3-amino-5-phenyloxolan-2-one?
The InChIKey is ODKXNQYXRPVRAR-RKDXNWHRSA-N. The full InChI is InChI=1S/C10H11NO2/c11-8-6-9(13-10(8)12)7-4-2-1-3-5-7/h1-5,8-9H,6,11H2/t8-,9-/m1/s1.
What are the key properties of (3R,5R)-3-amino-5-phenyloxolan-2-one?
(3R,5R)-3-amino-5-phenyloxolan-2-one has a molecular weight of 177.20 g/mol, XLogP of 1.00, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,5R)-3-amino-5-phenyloxolan-2-one is sourced from PubChem (CID 12521195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).