(2R)-5-amino-2-[(5-amino-2-methylpentanoyl)amino]-5-oxopentanoic acid

C11H21N3O4 — CID 107830220

IUPAC(2R)-5-amino-2-[(5-amino-2-methylpentanoyl)amino]-5-oxopentanoic acid
SMILESCC(CCCN)C(=O)N[C@H](CCC(N)=O)C(=O)O
InChIInChI=1S/C11H21N3O4/c1-7(3-2-6-12)10(16)14-8(11(17)18)4-5-9(13)15/h7-8H,2-6,12H2,1H3,(H2,13,15)(H,14,16)(H,17,18)/t7?,8-/m1/s1
InChIKeyWDEIEDDJHRRXOQ-BRFYHDHCSA-N
MW259.31 g/mol
LogP-0.80
Rot. Bonds9

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

(2R)-5-amino-2-[(5-amino-2-methylpentanoyl)amino]-5-oxopentanoic acid (PubChem CID 107830220) has the molecular formula C11H21N3O4 and a molecular weight of 259.31 g/mol. Its IUPAC name is (2R)-5-amino-2-[(5-amino-2-methylpentanoyl)amino]-5-oxopentanoic acid.

Molecular Properties

Compound Name(2R)-5-amino-2-[(5-amino-2-methylpentanoyl)amino]-5-oxopentanoic acid
PubChem CID107830220
Molecular FormulaC11H21N3O4
Molecular Weight259.31 g/mol
Exact Mass259.15
IUPAC Name(2R)-5-amino-2-[(5-amino-2-methylpentanoyl)amino]-5-oxopentanoic acid
SMILESCC(CCCN)C(=O)N[C@H](CCC(N)=O)C(=O)O
InChIInChI=1S/C11H21N3O4/c1-7(3-2-6-12)10(16)14-8(11(17)18)4-5-9(13)15/h7-8H,2-6,12H2,1H3,(H2,13,15)(H,14,16)(H,17,18)/t7?,8-/m1/s1
InChIKeyWDEIEDDJHRRXOQ-BRFYHDHCSA-N
XLogP-0.80
TPSA135.51 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 5-0.80
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Analyze (2R)-5-amino-2-[(5-amino-2-methylpentanoyl)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)-6-amino-2-[[(2S)-6-amino-2-methylhexanoyl]amino]hexanoic acid
CID 118056357
5-amino-2-(2-methyldodecanoylamino)-5-oxopentanoic acid
CID 90241102
2-[(5-amino-2-methylpentanoyl)amino]-4-hydroxybutanoic acid
CID 104684708
(2R)-2-[(5-amino-2-methylpentanoyl)amino]-4-hydroxybutanoic acid
CID 107825086
(2R)-2-[(5-amino-2-methylpentanoyl)amino]-3-hydroxypropanoic acid
CID 104685369
6-amino-2-[[5-amino-2-[[6-amino-2-[(2-amino-3-hydroxybutanoyl)amino]hexanoyl]amino]-5-oxopentanoyl]amino]hexanoic acid
CID 18749620
6-amino-2-[[5-amino-2-[[6-amino-2-[(2-amino-4-methylpentanoyl)amino]hexanoyl]amino]-5-oxopentanoyl]amino]hexanoic acid
CID 18298874
(2S)-5-amino-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2R)-2-[[(2R)-2-aminopropanoyl]amino]propanoyl]amino]propanoyl]amino]hexanoyl]amino]-5-oxopentanoic acid
CID 71445994
6-amino-2-[[2-[[5-amino-2-(2-aminopropanoylamino)-5-oxopentanoyl]amino]-3-carboxypropanoyl]amino]hexanoic acid
CID 18235038
6-amino-2-[[4-amino-2-[[5-amino-2-(2-aminopropanoylamino)-5-oxopentanoyl]amino]-4-oxobutanoyl]amino]hexanoic acid
CID 18235018
5-amino-2-[[5-amino-2-[[6-amino-2-[(2-amino-4-methylpentanoyl)amino]hexanoyl]amino]-5-oxopentanoyl]amino]-5-oxopentanoic acid
CID 18298869
(2S)-5-amino-2-[[(2S)-6-amino-2-[(2-aminoacetyl)amino]hexanoyl]amino]-5-oxopentanoic acid
CID 145455653

Frequently Asked Questions

What is the IUPAC name of (2R)-5-amino-2-[(5-amino-2-methylpentanoyl)amino]-5-oxopentanoic acid?
The IUPAC name of (2R)-5-amino-2-[(5-amino-2-methylpentanoyl)amino]-5-oxopentanoic acid (CID 107830220) is (2R)-5-amino-2-[(5-amino-2-methylpentanoyl)amino]-5-oxopentanoic acid.
What is the SMILES notation for (2R)-5-amino-2-[(5-amino-2-methylpentanoyl)amino]-5-oxopentanoic acid?
The canonical SMILES for (2R)-5-amino-2-[(5-amino-2-methylpentanoyl)amino]-5-oxopentanoic acid is CC(CCCN)C(=O)N[C@H](CCC(N)=O)C(=O)O.
What is the InChIKey of (2R)-5-amino-2-[(5-amino-2-methylpentanoyl)amino]-5-oxopentanoic acid?
The InChIKey is WDEIEDDJHRRXOQ-BRFYHDHCSA-N. The full InChI is InChI=1S/C11H21N3O4/c1-7(3-2-6-12)10(16)14-8(11(17)18)4-5-9(13)15/h7-8H,2-6,12H2,1H3,(H2,13,15)(H,14,16)(H,17,18)/t7?,8-/m1/s1.
What are the key properties of (2R)-5-amino-2-[(5-amino-2-methylpentanoyl)amino]-5-oxopentanoic acid?
(2R)-5-amino-2-[(5-amino-2-methylpentanoyl)amino]-5-oxopentanoic acid has a molecular weight of 259.31 g/mol, XLogP of -0.80, 9 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-5-amino-2-[(5-amino-2-methylpentanoyl)amino]-5-oxopentanoic acid is sourced from PubChem (CID 107830220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).