(2R)-5-amino-2-[[2-(2,5-dimethylphenyl)acetyl]amino]-5-oxopentanoic acid

C15H20N2O4 — CID 107829986

IUPAC(2R)-5-amino-2-[[2-(2,5-dimethylphenyl)acetyl]amino]-5-oxopentanoic acid
SMILESCc1ccc(C)c(CC(=O)N[C@H](CCC(N)=O)C(=O)O)c1
InChIInChI=1S/C15H20N2O4/c1-9-3-4-10(2)11(7-9)8-14(19)17-12(15(20)21)5-6-13(16)18/h3-4,7,12H,5-6,8H2,1-2H3,(H2,16,18)(H,17,19)(H,20,21)/t12-/m1/s1
InChIKeyWUTUMCYTESBIQI-GFCCVEGCSA-N
MW292.34 g/mol
LogP0.68
Rot. Bonds7

About (2R)-5-amino-2-[[2-(2,5-dimethylphenyl)acetyl]amino]-5-oxopentanoic acid

(2R)-5-amino-2-[[2-(2,5-dimethylphenyl)acetyl]amino]-5-oxopentanoic acid (PubChem CID 107829986) has the molecular formula C15H20N2O4 and a molecular weight of 292.34 g/mol. Its IUPAC name is (2R)-5-amino-2-[[2-(2,5-dimethylphenyl)acetyl]amino]-5-oxopentanoic acid.

Molecular Properties

Compound Name(2R)-5-amino-2-[[2-(2,5-dimethylphenyl)acetyl]amino]-5-oxopentanoic acid
PubChem CID107829986
Molecular FormulaC15H20N2O4
Molecular Weight292.34 g/mol
Exact Mass292.14
IUPAC Name(2R)-5-amino-2-[[2-(2,5-dimethylphenyl)acetyl]amino]-5-oxopentanoic acid
SMILESCc1ccc(C)c(CC(=O)N[C@H](CCC(N)=O)C(=O)O)c1
InChIInChI=1S/C15H20N2O4/c1-9-3-4-10(2)11(7-9)8-14(19)17-12(15(20)21)5-6-13(16)18/h3-4,7,12H,5-6,8H2,1-2H3,(H2,16,18)(H,17,19)(H,20,21)/t12-/m1/s1
InChIKeyWUTUMCYTESBIQI-GFCCVEGCSA-N
XLogP0.68
TPSA109.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 50.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze (2R)-5-amino-2-[[2-(2,5-dimethylphenyl)acetyl]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

2-[[2-(2,5-dimethylphenyl)acetyl]amino]-4-methoxybutanoic acid
CID 62539659
(2S)-5-amino-2-[(2,4-dimethylphenyl)methylamino]-5-oxopentanoic acid
CID 67619717
(2R)-5-amino-2-[3-(2-methylphenyl)propanoylamino]-5-oxopentanoic acid
CID 107830087
(2S)-2-[[2-(2,5-dimethylphenyl)acetyl]amino]propanoic acid
CID 62538173
5-amino-2-[3-(4-methylphenyl)propanoylamino]-5-oxopentanoic acid
CID 43358715
5-amino-2-[3-(4-methylphenoxy)propanoylamino]-5-oxopentanoic acid
CID 108789938
CID 68604008
CID 68604008
5-[[2-(2,5-dimethylphenyl)acetyl]amino]hexanoic acid
CID 82854155
(2R)-5-amino-2-[(2-fluoro-5-methylbenzoyl)amino]-5-oxopentanoic acid
CID 107830031
(2S)-2-[[2-(2,5-dimethylphenyl)acetyl]amino]-3,3-dimethylbutanoic acid
CID 62538832
5-amino-2-[(3-methylbenzoyl)amino]-5-oxopentanoic acid
CID 43176049
(2S)-5-amino-2-[(3,4-dimethylphenyl)carbamoylamino]-5-oxopentanoic acid
CID 61191311

Frequently Asked Questions

What is the IUPAC name of (2R)-5-amino-2-[[2-(2,5-dimethylphenyl)acetyl]amino]-5-oxopentanoic acid?
The IUPAC name of (2R)-5-amino-2-[[2-(2,5-dimethylphenyl)acetyl]amino]-5-oxopentanoic acid (CID 107829986) is (2R)-5-amino-2-[[2-(2,5-dimethylphenyl)acetyl]amino]-5-oxopentanoic acid.
What is the SMILES notation for (2R)-5-amino-2-[[2-(2,5-dimethylphenyl)acetyl]amino]-5-oxopentanoic acid?
The canonical SMILES for (2R)-5-amino-2-[[2-(2,5-dimethylphenyl)acetyl]amino]-5-oxopentanoic acid is Cc1ccc(C)c(CC(=O)N[C@H](CCC(N)=O)C(=O)O)c1.
What is the InChIKey of (2R)-5-amino-2-[[2-(2,5-dimethylphenyl)acetyl]amino]-5-oxopentanoic acid?
The InChIKey is WUTUMCYTESBIQI-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H20N2O4/c1-9-3-4-10(2)11(7-9)8-14(19)17-12(15(20)21)5-6-13(16)18/h3-4,7,12H,5-6,8H2,1-2H3,(H2,16,18)(H,17,19)(H,20,21)/t12-/m1/s1.
What are the key properties of (2R)-5-amino-2-[[2-(2,5-dimethylphenyl)acetyl]amino]-5-oxopentanoic acid?
(2R)-5-amino-2-[[2-(2,5-dimethylphenyl)acetyl]amino]-5-oxopentanoic acid has a molecular weight of 292.34 g/mol, XLogP of 0.68, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-5-amino-2-[[2-(2,5-dimethylphenyl)acetyl]amino]-5-oxopentanoic acid is sourced from PubChem (CID 107829986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).