(2R)-5-amino-5-oxo-2-[[(2R)-piperidine-2-carbonyl]amino]pentanoic acid

C11H19N3O4 — CID 107830274

IUPAC(2R)-5-amino-5-oxo-2-[[(2R)-piperidine-2-carbonyl]amino]pentanoic acid
SMILESNC(=O)CC[C@@H](NC(=O)[C@H]1CCCCN1)C(=O)O
InChIInChI=1S/C11H19N3O4/c12-9(15)5-4-8(11(17)18)14-10(16)7-3-1-2-6-13-7/h7-8,13H,1-6H2,(H2,12,15)(H,14,16)(H,17,18)/t7-,8-/m1/s1
InChIKeyQMIHUGYEHQGSCX-HTQZYQBOSA-N
MW257.29 g/mol
LogP-1.04
Rot. Bonds6

About (2R)-5-amino-5-oxo-2-[[(2R)-piperidine-2-carbonyl]amino]pentanoic acid

(2R)-5-amino-5-oxo-2-[[(2R)-piperidine-2-carbonyl]amino]pentanoic acid (PubChem CID 107830274) has the molecular formula C11H19N3O4 and a molecular weight of 257.29 g/mol. Its IUPAC name is (2R)-5-amino-5-oxo-2-[[(2R)-piperidine-2-carbonyl]amino]pentanoic acid.

Molecular Properties

Compound Name(2R)-5-amino-5-oxo-2-[[(2R)-piperidine-2-carbonyl]amino]pentanoic acid
PubChem CID107830274
Molecular FormulaC11H19N3O4
Molecular Weight257.29 g/mol
Exact Mass257.14
IUPAC Name(2R)-5-amino-5-oxo-2-[[(2R)-piperidine-2-carbonyl]amino]pentanoic acid
SMILESNC(=O)CC[C@@H](NC(=O)[C@H]1CCCCN1)C(=O)O
InChIInChI=1S/C11H19N3O4/c12-9(15)5-4-8(11(17)18)14-10(16)7-3-1-2-6-13-7/h7-8,13H,1-6H2,(H2,12,15)(H,14,16)(H,17,18)/t7-,8-/m1/s1
InChIKeyQMIHUGYEHQGSCX-HTQZYQBOSA-N
XLogP-1.04
TPSA121.52 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 5-1.04
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Analyze (2R)-5-amino-5-oxo-2-[[(2R)-piperidine-2-carbonyl]amino]pentanoic acid with MolForge

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Related Compounds

(2S)-5-amino-2-(azepane-2-carbonylamino)-5-oxopentanoic acid
CID 64564036
5-amino-2-[[3-hydroxy-2-(pyrrolidine-2-carbonylamino)propanoyl]amino]-5-oxopentanoic acid
CID 18223693
(2S)-2-(pyrrolidine-2-carbonylamino)pentanedioic acid
CID 61159815
(2S)-6-amino-2-[[(2S)-5-amino-5-oxo-2-[[(2S)-pyrrolidine-2-carbonyl]amino]pentanoyl]amino]hexanoic acid
CID 145457448
2-[[(2S)-piperidine-2-carbonyl]amino]pentanoic acid
CID 103869509
5-amino-2-[[4-methylsulfanyl-2-(pyrrolidine-2-carbonylamino)butanoyl]amino]-5-oxopentanoic acid
CID 18223642
(2R)-4-amino-4-oxo-2-[[(2S)-pyrrolidine-2-carbonyl]amino]butanoic acid
CID 103870279
3-hydroxy-2-[[(2R)-piperidine-2-carbonyl]amino]propanoic acid
CID 104913543
(2R)-5-methoxy-5-oxo-2-[[(2S)-pyrrolidine-2-carbonyl]amino]pentanoic acid
CID 103870572
4-hydroxy-2-[[(2R)-pyrrolidine-2-carbonyl]amino]butanoic acid
CID 104901043
2-[[(2R)-piperidine-2-carbonyl]amino]butanoic acid
CID 104913581
(2S)-5-amino-2-[[(2S)-5-amino-2-[[2-[[(2S)-5-amino-5-oxo-2-[[2-[[(2S)-pyrrolidine-2-carbonyl]amino]acetyl]amino]pentanoyl]amino]acetyl]amino]-5-oxopentanoyl]amino]-5-oxopentanoic acid
CID 71353098

Frequently Asked Questions

What is the IUPAC name of (2R)-5-amino-5-oxo-2-[[(2R)-piperidine-2-carbonyl]amino]pentanoic acid?
The IUPAC name of (2R)-5-amino-5-oxo-2-[[(2R)-piperidine-2-carbonyl]amino]pentanoic acid (CID 107830274) is (2R)-5-amino-5-oxo-2-[[(2R)-piperidine-2-carbonyl]amino]pentanoic acid.
What is the SMILES notation for (2R)-5-amino-5-oxo-2-[[(2R)-piperidine-2-carbonyl]amino]pentanoic acid?
The canonical SMILES for (2R)-5-amino-5-oxo-2-[[(2R)-piperidine-2-carbonyl]amino]pentanoic acid is NC(=O)CC[C@@H](NC(=O)[C@H]1CCCCN1)C(=O)O.
What is the InChIKey of (2R)-5-amino-5-oxo-2-[[(2R)-piperidine-2-carbonyl]amino]pentanoic acid?
The InChIKey is QMIHUGYEHQGSCX-HTQZYQBOSA-N. The full InChI is InChI=1S/C11H19N3O4/c12-9(15)5-4-8(11(17)18)14-10(16)7-3-1-2-6-13-7/h7-8,13H,1-6H2,(H2,12,15)(H,14,16)(H,17,18)/t7-,8-/m1/s1.
What are the key properties of (2R)-5-amino-5-oxo-2-[[(2R)-piperidine-2-carbonyl]amino]pentanoic acid?
(2R)-5-amino-5-oxo-2-[[(2R)-piperidine-2-carbonyl]amino]pentanoic acid has a molecular weight of 257.29 g/mol, XLogP of -1.04, 6 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-5-amino-5-oxo-2-[[(2R)-piperidine-2-carbonyl]amino]pentanoic acid is sourced from PubChem (CID 107830274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).