(4S,5R)-1-benzyl-5-methyl-4-phenylimidazolidin-2-one

C17H18N2O — CID 131844665

IUPAC(4S,5R)-1-benzyl-5-methyl-4-phenylimidazolidin-2-one
SMILESC[C@@H]1[C@H](c2ccccc2)NC(=O)N1Cc1ccccc1
InChIInChI=1S/C17H18N2O/c1-13-16(15-10-6-3-7-11-15)18-17(20)19(13)12-14-8-4-2-5-9-14/h2-11,13,16H,12H2,1H3,(H,18,20)/t13-,16-/m1/s1
InChIKeyGETMYJSFUOTOER-CZUORRHYSA-N
MW266.34 g/mol
LogP3.34
Rot. Bonds3

About (4S,5R)-1-benzyl-5-methyl-4-phenylimidazolidin-2-one

(4S,5R)-1-benzyl-5-methyl-4-phenylimidazolidin-2-one (PubChem CID 131844665) has the molecular formula C17H18N2O and a molecular weight of 266.34 g/mol. Its IUPAC name is (4S,5R)-1-benzyl-5-methyl-4-phenylimidazolidin-2-one.

Molecular Properties

Compound Name(4S,5R)-1-benzyl-5-methyl-4-phenylimidazolidin-2-one
PubChem CID131844665
Molecular FormulaC17H18N2O
Molecular Weight266.34 g/mol
Exact Mass266.14
IUPAC Name(4S,5R)-1-benzyl-5-methyl-4-phenylimidazolidin-2-one
SMILESC[C@@H]1[C@H](c2ccccc2)NC(=O)N1Cc1ccccc1
InChIInChI=1S/C17H18N2O/c1-13-16(15-10-6-3-7-11-15)18-17(20)19(13)12-14-8-4-2-5-9-14/h2-11,13,16H,12H2,1H3,(H,18,20)/t13-,16-/m1/s1
InChIKeyGETMYJSFUOTOER-CZUORRHYSA-N
XLogP3.34
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-acetyl-1-benzyl-6-methyl-4-phenyl-1,3-diazinan-2-one
CID 73324809
(4R,5R)-1-benzyl-4-(2-hydroxyethyl)-5-methylimidazolidin-2-one
CID 24787335
(4S,5S)-3-benzyl-4-methyl-5-phenyl-1,3-oxazolidin-2-one
CID 11086728
(4R,5S)-1-benzyl-4-methyl-5-phenylimidazolidine-2-thione
CID 170900554
1-benzyl-4-methyl-3-methylideneazetidin-2-one
CID 12680777
3-benzyl-2,5,5-trimethylimidazolidin-4-one
CID 83706003
(3aR,6aR)-4-benzyl-3,3a,6,6a-tetrahydro-1H-imidazo[4,5-d]imidazole-2,5-dione
CID 99646895
(5S)-1-benzyl-5-phenylimidazolidine-2,4-dione
CID 28819549
(3S,5R)-1-benzyl-5-methyl-3-phenylpyrrolidin-2-one
CID 102599255
(3R,5R)-1-benzyl-3-methyl-5-phenylpyrrolidin-2-one
CID 102276897
3-benzyl-2-oxo-5-propan-2-ylimidazolidine-4-carboxylic acid
CID 66523901
1-benzyl-4-phenylazetidin-2-one;ethane
CID 91301101

Frequently Asked Questions

What is the IUPAC name of (4S,5R)-1-benzyl-5-methyl-4-phenylimidazolidin-2-one?
The IUPAC name of (4S,5R)-1-benzyl-5-methyl-4-phenylimidazolidin-2-one (CID 131844665) is (4S,5R)-1-benzyl-5-methyl-4-phenylimidazolidin-2-one.
What is the SMILES notation for (4S,5R)-1-benzyl-5-methyl-4-phenylimidazolidin-2-one?
The canonical SMILES for (4S,5R)-1-benzyl-5-methyl-4-phenylimidazolidin-2-one is C[C@@H]1[C@H](c2ccccc2)NC(=O)N1Cc1ccccc1.
What is the InChIKey of (4S,5R)-1-benzyl-5-methyl-4-phenylimidazolidin-2-one?
The InChIKey is GETMYJSFUOTOER-CZUORRHYSA-N. The full InChI is InChI=1S/C17H18N2O/c1-13-16(15-10-6-3-7-11-15)18-17(20)19(13)12-14-8-4-2-5-9-14/h2-11,13,16H,12H2,1H3,(H,18,20)/t13-,16-/m1/s1.
What are the key properties of (4S,5R)-1-benzyl-5-methyl-4-phenylimidazolidin-2-one?
(4S,5R)-1-benzyl-5-methyl-4-phenylimidazolidin-2-one has a molecular weight of 266.34 g/mol, XLogP of 3.34, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4S,5R)-1-benzyl-5-methyl-4-phenylimidazolidin-2-one is sourced from PubChem (CID 131844665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).