(2R)-5-amino-2-[(3-amino-2-phenylpropanoyl)amino]-5-oxopentanoic acid

C14H19N3O4 — CID 107830298

IUPAC(2R)-5-amino-2-[(3-amino-2-phenylpropanoyl)amino]-5-oxopentanoic acid
SMILESNCC(C(=O)N[C@H](CCC(N)=O)C(=O)O)c1ccccc1
InChIInChI=1S/C14H19N3O4/c15-8-10(9-4-2-1-3-5-9)13(19)17-11(14(20)21)6-7-12(16)18/h1-5,10-11H,6-8,15H2,(H2,16,18)(H,17,19)(H,20,21)/t10?,11-/m1/s1
InChIKeyVLGCXMYUKKJSKI-RRKGBCIJSA-N
MW293.32 g/mol
LogP-0.44
Rot. Bonds8

About (2R)-5-amino-2-[(3-amino-2-phenylpropanoyl)amino]-5-oxopentanoic acid

(2R)-5-amino-2-[(3-amino-2-phenylpropanoyl)amino]-5-oxopentanoic acid (PubChem CID 107830298) has the molecular formula C14H19N3O4 and a molecular weight of 293.32 g/mol. Its IUPAC name is (2R)-5-amino-2-[(3-amino-2-phenylpropanoyl)amino]-5-oxopentanoic acid.

Molecular Properties

Compound Name(2R)-5-amino-2-[(3-amino-2-phenylpropanoyl)amino]-5-oxopentanoic acid
PubChem CID107830298
Molecular FormulaC14H19N3O4
Molecular Weight293.32 g/mol
Exact Mass293.14
IUPAC Name(2R)-5-amino-2-[(3-amino-2-phenylpropanoyl)amino]-5-oxopentanoic acid
SMILESNCC(C(=O)N[C@H](CCC(N)=O)C(=O)O)c1ccccc1
InChIInChI=1S/C14H19N3O4/c15-8-10(9-4-2-1-3-5-9)13(19)17-11(14(20)21)6-7-12(16)18/h1-5,10-11H,6-8,15H2,(H2,16,18)(H,17,19)(H,20,21)/t10?,11-/m1/s1
InChIKeyVLGCXMYUKKJSKI-RRKGBCIJSA-N
XLogP-0.44
TPSA135.51 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.32
LogP ≤ 5-0.44
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Analyze (2R)-5-amino-2-[(3-amino-2-phenylpropanoyl)amino]-5-oxopentanoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-2-[(3-amino-2-phenylpropanoyl)amino]hexanoic acid
CID 107147010
3-amino-N-(1,3-dihydroxypropan-2-yl)-2-phenylpropanamide
CID 65314592
(2R)-5-amino-2-[[2-(aminomethyl)-3-methylbutanoyl]amino]-5-oxopentanoic acid
CID 107830332
CID 68604008
CID 68604008
2-[(3-amino-2-phenylpropanoyl)amino]-3-methylbutanamide
CID 106344661
5-amino-5-oxo-2-(phenoxycarbonylamino)pentanoic acid
CID 23278909
(2S)-4-hydroxy-2-(2-phenylbutanoylamino)butanoic acid
CID 67038648
(2S)-5-amino-2-anilino-5-oxopentanoic acid
CID 54197392
3-amino-N-(1-hydroxypropan-2-yl)-2-phenylpropanamide
CID 62877991
(2S)-5-amino-2-(benzylcarbamoylamino)-5-oxopentanoic acid
CID 61181145
5-amino-2-[[2-[[2-[(2-aminoacetyl)amino]-4-carboxybutanoyl]amino]-3-phenylpropanoyl]amino]-5-oxopentanoic acid
CID 18486997
5-amino-2-[[2-[[2-[(2-aminoacetyl)amino]-3-carboxypropanoyl]amino]-3-phenylpropanoyl]amino]-5-oxopentanoic acid
CID 18486202

Frequently Asked Questions

What is the IUPAC name of (2R)-5-amino-2-[(3-amino-2-phenylpropanoyl)amino]-5-oxopentanoic acid?
The IUPAC name of (2R)-5-amino-2-[(3-amino-2-phenylpropanoyl)amino]-5-oxopentanoic acid (CID 107830298) is (2R)-5-amino-2-[(3-amino-2-phenylpropanoyl)amino]-5-oxopentanoic acid.
What is the SMILES notation for (2R)-5-amino-2-[(3-amino-2-phenylpropanoyl)amino]-5-oxopentanoic acid?
The canonical SMILES for (2R)-5-amino-2-[(3-amino-2-phenylpropanoyl)amino]-5-oxopentanoic acid is NCC(C(=O)N[C@H](CCC(N)=O)C(=O)O)c1ccccc1.
What is the InChIKey of (2R)-5-amino-2-[(3-amino-2-phenylpropanoyl)amino]-5-oxopentanoic acid?
The InChIKey is VLGCXMYUKKJSKI-RRKGBCIJSA-N. The full InChI is InChI=1S/C14H19N3O4/c15-8-10(9-4-2-1-3-5-9)13(19)17-11(14(20)21)6-7-12(16)18/h1-5,10-11H,6-8,15H2,(H2,16,18)(H,17,19)(H,20,21)/t10?,11-/m1/s1.
What are the key properties of (2R)-5-amino-2-[(3-amino-2-phenylpropanoyl)amino]-5-oxopentanoic acid?
(2R)-5-amino-2-[(3-amino-2-phenylpropanoyl)amino]-5-oxopentanoic acid has a molecular weight of 293.32 g/mol, XLogP of -0.44, 8 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-5-amino-2-[(3-amino-2-phenylpropanoyl)amino]-5-oxopentanoic acid is sourced from PubChem (CID 107830298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).