N-benzyl-2-(2-oxoazetidin-1-yl)-3-phenylpropanamide

C19H20N2O2 — CID 5278763

IUPACN-benzyl-2-(2-oxoazetidin-1-yl)-3-phenylpropanamide
SMILESO=C(NCc1ccccc1)C(Cc1ccccc1)N1CCC1=O
InChIInChI=1S/C19H20N2O2/c22-18-11-12-21(18)17(13-15-7-3-1-4-8-15)19(23)20-14-16-9-5-2-6-10-16/h1-10,17H,11-14H2,(H,20,23)
InChIKeyHUADVIIJQLJCII-UHFFFAOYSA-N
MW308.38 g/mol
LogP2.15
Rot. Bonds6

About N-benzyl-2-(2-oxoazetidin-1-yl)-3-phenylpropanamide

N-benzyl-2-(2-oxoazetidin-1-yl)-3-phenylpropanamide (PubChem CID 5278763) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is N-benzyl-2-(2-oxoazetidin-1-yl)-3-phenylpropanamide.

Molecular Properties

Compound NameN-benzyl-2-(2-oxoazetidin-1-yl)-3-phenylpropanamide
PubChem CID5278763
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC NameN-benzyl-2-(2-oxoazetidin-1-yl)-3-phenylpropanamide
SMILESO=C(NCc1ccccc1)C(Cc1ccccc1)N1CCC1=O
InChIInChI=1S/C19H20N2O2/c22-18-11-12-21(18)17(13-15-7-3-1-4-8-15)19(23)20-14-16-9-5-2-6-10-16/h1-10,17H,11-14H2,(H,20,23)
InChIKeyHUADVIIJQLJCII-UHFFFAOYSA-N
XLogP2.15
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-[(3S)-3-amino-2-oxoazepan-1-yl]-N-benzyl-3-phenylpropanamide
CID 59757318
(2S)-N-benzyl-2-[(1R,2R,6R,7R)-3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl]-3-phenylpropanamide
CID 124717216
(2S)-N-benzyl-2-[(1S,2R,6R,7S)-3,5-dioxo-4-azatricyclo[5.2.1.02,6]decan-4-yl]-3-phenylpropanamide
CID 124536693
N-benzyl-2-(2,5-dioxopyrrolidin-1-yl)-2-fluoroacetamide
CID 11043632
2-(2-oxopiperidin-1-yl)-2-phenyl-N-[[4-(phenylmethoxymethyl)phenyl]methyl]acetamide
CID 56577878
N-(furan-2-ylmethyl)-2-(3-oxo-1H-isoindol-2-yl)-3-phenylpropanamide
CID 71947979
1-[(2R)-1-hydroxy-3-phenylpropan-2-yl]pyrrolidin-2-one
CID 107861552
(2S)-N-benzyl-2-(2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)butanamide
CID 92742614
(2R)-2-(3-oxo-1H-isoindol-2-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]-3-phenylpropanamide
CID 92886577
2-(1,3-dioxoisoindol-2-yl)-3-phenyl-N-[[4-(propan-2-yloxymethyl)phenyl]methyl]propanamide
CID 55797864
N-(2-methylpropyl)-2-(3-oxo-1H-isoindol-2-yl)-3-phenylpropanamide
CID 71947985
2-(2,7-dioxoazepan-1-yl)-3-phenylpropanoic acid
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Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-(2-oxoazetidin-1-yl)-3-phenylpropanamide?
The IUPAC name of N-benzyl-2-(2-oxoazetidin-1-yl)-3-phenylpropanamide (CID 5278763) is N-benzyl-2-(2-oxoazetidin-1-yl)-3-phenylpropanamide.
What is the SMILES notation for N-benzyl-2-(2-oxoazetidin-1-yl)-3-phenylpropanamide?
The canonical SMILES for N-benzyl-2-(2-oxoazetidin-1-yl)-3-phenylpropanamide is O=C(NCc1ccccc1)C(Cc1ccccc1)N1CCC1=O.
What is the InChIKey of N-benzyl-2-(2-oxoazetidin-1-yl)-3-phenylpropanamide?
The InChIKey is HUADVIIJQLJCII-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c22-18-11-12-21(18)17(13-15-7-3-1-4-8-15)19(23)20-14-16-9-5-2-6-10-16/h1-10,17H,11-14H2,(H,20,23).
What are the key properties of N-benzyl-2-(2-oxoazetidin-1-yl)-3-phenylpropanamide?
N-benzyl-2-(2-oxoazetidin-1-yl)-3-phenylpropanamide has a molecular weight of 308.38 g/mol, XLogP of 2.15, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(2-oxoazetidin-1-yl)-3-phenylpropanamide is sourced from PubChem (CID 5278763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).