(3R,4S)-3-hydroxy-1,4-diphenylazetidin-2-one

C15H13NO2 — CID 11424956

IUPAC(3R,4S)-3-hydroxy-1,4-diphenylazetidin-2-one
SMILESO=C1[C@H](O)[C@H](c2ccccc2)N1c1ccccc1
InChIInChI=1S/C15H13NO2/c17-14-13(11-7-3-1-4-8-11)16(15(14)18)12-9-5-2-6-10-12/h1-10,13-14,17H/t13-,14+/m0/s1
InChIKeyNFENQWXNKKLJIX-UONOGXRCSA-N
MW239.27 g/mol
LogP2.14
Rot. Bonds2

About (3R,4S)-3-hydroxy-1,4-diphenylazetidin-2-one

(3R,4S)-3-hydroxy-1,4-diphenylazetidin-2-one (PubChem CID 11424956) has the molecular formula C15H13NO2 and a molecular weight of 239.27 g/mol. Its IUPAC name is (3R,4S)-3-hydroxy-1,4-diphenylazetidin-2-one.

Molecular Properties

Compound Name(3R,4S)-3-hydroxy-1,4-diphenylazetidin-2-one
PubChem CID11424956
Molecular FormulaC15H13NO2
Molecular Weight239.27 g/mol
Exact Mass239.09
IUPAC Name(3R,4S)-3-hydroxy-1,4-diphenylazetidin-2-one
SMILESO=C1[C@H](O)[C@H](c2ccccc2)N1c1ccccc1
InChIInChI=1S/C15H13NO2/c17-14-13(11-7-3-1-4-8-11)16(15(14)18)12-9-5-2-6-10-12/h1-10,13-14,17H/t13-,14+/m0/s1
InChIKeyNFENQWXNKKLJIX-UONOGXRCSA-N
XLogP2.14
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3S,4R)-4-hydroxy-2,3-diphenyl-3,4-dihydroisoquinolin-1-one
CID 12694467
(3S,4R)-3-hydroxy-1,4-bis(4-methoxyphenyl)azetidin-2-one
CID 11392395
3-acetyl-1,4-diphenylazetidin-2-one
CID 12575792
(3S,4S)-3-[(1S)-1,2-dihydroxyethyl]-1,4-diphenylazetidin-2-one
CID 10755410
(3S,4S)-3-methyl-1-(4-methylphenyl)-4-phenylazetidin-2-one
CID 154718550
(3S,4S)-3-benzyl-1,4-diphenylazetidin-2-one
CID 1236505
(3S,4R)-4-(4-chlorophenyl)-1,3-diphenylazetidin-2-one
CID 71385795
(3R,4S)-3-amino-1-(4-fluorophenyl)-4-phenylazetidin-2-one
CID 124503328
(3S,4R)-3-ethenyl-1-(4-methoxyphenyl)-4-phenylazetidin-2-one
CID 14068192
(4R)-1-(3,5-dimethoxyphenyl)-3-hydroxy-4-(4-methoxyphenyl)azetidin-2-one
CID 144520050
(3S,4S)-1-(3,5-dimethoxyphenyl)-3-hydroxy-4-(4-methoxyphenyl)azetidin-2-one
CID 56963906
3-(methoxymethoxy)-1,4-diphenylazetidin-2-one
CID 500118

Frequently Asked Questions

What is the IUPAC name of (3R,4S)-3-hydroxy-1,4-diphenylazetidin-2-one?
The IUPAC name of (3R,4S)-3-hydroxy-1,4-diphenylazetidin-2-one (CID 11424956) is (3R,4S)-3-hydroxy-1,4-diphenylazetidin-2-one.
What is the SMILES notation for (3R,4S)-3-hydroxy-1,4-diphenylazetidin-2-one?
The canonical SMILES for (3R,4S)-3-hydroxy-1,4-diphenylazetidin-2-one is O=C1[C@H](O)[C@H](c2ccccc2)N1c1ccccc1.
What is the InChIKey of (3R,4S)-3-hydroxy-1,4-diphenylazetidin-2-one?
The InChIKey is NFENQWXNKKLJIX-UONOGXRCSA-N. The full InChI is InChI=1S/C15H13NO2/c17-14-13(11-7-3-1-4-8-11)16(15(14)18)12-9-5-2-6-10-12/h1-10,13-14,17H/t13-,14+/m0/s1.
What are the key properties of (3R,4S)-3-hydroxy-1,4-diphenylazetidin-2-one?
(3R,4S)-3-hydroxy-1,4-diphenylazetidin-2-one has a molecular weight of 239.27 g/mol, XLogP of 2.14, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,4S)-3-hydroxy-1,4-diphenylazetidin-2-one is sourced from PubChem (CID 11424956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).