(2S)-2-amino-N-phenacyl-3-phenylpropanamide

C17H18N2O2 — CID 54565286

IUPAC(2S)-2-amino-N-phenacyl-3-phenylpropanamide
SMILESN[C@@H](Cc1ccccc1)C(=O)NCC(=O)c1ccccc1
InChIInChI=1S/C17H18N2O2/c18-15(11-13-7-3-1-4-8-13)17(21)19-12-16(20)14-9-5-2-6-10-14/h1-10,15H,11-12,18H2,(H,19,21)/t15-/m0/s1
InChIKeyZTJRMZYIUJGOAF-HNNXBMFYSA-N
MW282.34 g/mol
LogP1.56
Rot. Bonds6

About (2S)-2-amino-N-phenacyl-3-phenylpropanamide

(2S)-2-amino-N-phenacyl-3-phenylpropanamide (PubChem CID 54565286) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is (2S)-2-amino-N-phenacyl-3-phenylpropanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-phenacyl-3-phenylpropanamide
PubChem CID54565286
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC Name(2S)-2-amino-N-phenacyl-3-phenylpropanamide
SMILESN[C@@H](Cc1ccccc1)C(=O)NCC(=O)c1ccccc1
InChIInChI=1S/C17H18N2O2/c18-15(11-13-7-3-1-4-8-13)17(21)19-12-16(20)14-9-5-2-6-10-14/h1-10,15H,11-12,18H2,(H,19,21)/t15-/m0/s1
InChIKeyZTJRMZYIUJGOAF-HNNXBMFYSA-N
XLogP1.56
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(3-chloro-2-oxopropyl)-3-phenylpropanamide
CID 134891697
methyl 2-[(2-amino-3-phenylpropanoyl)amino]acetate;hydrochloride
CID 70536433
methyl 2-[[(2S)-2-amino-3-phenylpropanoyl]amino]acetate;hydrochloride
CID 13131506
(2S)-2-amino-N-[(2S)-2-amino-3-phenylpropanoyl]-3-phenylpropanamide
CID 21116073
2-amino-N-[2-(ethylamino)-2-oxoethyl]-3-phenylpropanamide;hydrochloride
CID 119271418
2-amino-N-ethyl-3-phenylpropanamide;hydrochloride
CID 53409094
(2S)-2-amino-3-phenyl-N-(2-phenylethyl)propanamide;hydrochloride
CID 21308260
(2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-phenylpropanamide
CID 55030074
(2S)-2-amino-3-((613C)cyclohexatrienyl)propanoic acid
CID 66995721
(2S)-2-amino-N-[2-[2-[[(2S)-2-amino-3-phenylpropanoyl]amino]ethyldisulfanyl]ethyl]-3-phenylpropanamide
CID 10388888
(2S)-2-amino-N-(3-methylbutyl)-3-phenylpropanamide
CID 10399143
(2R)-2-amino-N-but-2-ynyl-3-phenylpropanamide
CID 104861124

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-phenacyl-3-phenylpropanamide?
The IUPAC name of (2S)-2-amino-N-phenacyl-3-phenylpropanamide (CID 54565286) is (2S)-2-amino-N-phenacyl-3-phenylpropanamide.
What is the SMILES notation for (2S)-2-amino-N-phenacyl-3-phenylpropanamide?
The canonical SMILES for (2S)-2-amino-N-phenacyl-3-phenylpropanamide is N[C@@H](Cc1ccccc1)C(=O)NCC(=O)c1ccccc1.
What is the InChIKey of (2S)-2-amino-N-phenacyl-3-phenylpropanamide?
The InChIKey is ZTJRMZYIUJGOAF-HNNXBMFYSA-N. The full InChI is InChI=1S/C17H18N2O2/c18-15(11-13-7-3-1-4-8-13)17(21)19-12-16(20)14-9-5-2-6-10-14/h1-10,15H,11-12,18H2,(H,19,21)/t15-/m0/s1.
What are the key properties of (2S)-2-amino-N-phenacyl-3-phenylpropanamide?
(2S)-2-amino-N-phenacyl-3-phenylpropanamide has a molecular weight of 282.34 g/mol, XLogP of 1.56, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-phenacyl-3-phenylpropanamide is sourced from PubChem (CID 54565286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).