2-aminopentanedioic acid;piperidine

C10H20N2O4 — CID 19704542

IUPAC2-aminopentanedioic acid;piperidine
SMILESC1CCNCC1.NC(CCC(=O)O)C(=O)O
InChIInChI=1S/C5H9NO4.C5H11N/c6-3(5(9)10)1-2-4(7)8;1-2-4-6-5-3-1/h3H,1-2,6H2,(H,7,8)(H,9,10);6H,1-5H2
InChIKeyJZUYQMYQLYTELG-UHFFFAOYSA-N
MW232.28 g/mol
LogP0.02
Rot. Bonds4

About 2-aminopentanedioic acid;piperidine

2-aminopentanedioic acid;piperidine (PubChem CID 19704542) has the molecular formula C10H20N2O4 and a molecular weight of 232.28 g/mol. Its IUPAC name is 2-aminopentanedioic acid;piperidine.

Molecular Properties

Compound Name2-aminopentanedioic acid;piperidine
PubChem CID19704542
Molecular FormulaC10H20N2O4
Molecular Weight232.28 g/mol
Exact Mass232.14
IUPAC Name2-aminopentanedioic acid;piperidine
SMILESC1CCNCC1.NC(CCC(=O)O)C(=O)O
InChIInChI=1S/C5H9NO4.C5H11N/c6-3(5(9)10)1-2-4(7)8;1-2-4-6-5-3-1/h3H,1-2,6H2,(H,7,8)(H,9,10);6H,1-5H2
InChIKeyJZUYQMYQLYTELG-UHFFFAOYSA-N
XLogP0.02
TPSA112.65 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 50.02
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-aminopentanedioic acid;chromium
CID 87792997
2-aminopentanedioic acid
CID 611
(2R)-2-amino(1,2,3,4,5-13C5)pentanedioic acid
CID 121494059
2-aminopentanedioic acid;bis(butanedioic acid)
CID 174955338
(2S)-2-aminopentanedioic acid;heptahydrate
CID 156766287
(2R)-2-aminopentanedioic acid;hydrate
CID 87451212
(2S)-2-aminopentanedioic acid;hydrobromide
CID 87753976
2-aminopentanedioic acid;hexahydrate
CID 173177476
(2S)-2-aminopentanedioic acid;trihydrochloride
CID 140679884
CID 87237505
CID 87237505
strontium;(2R)-2-aminopentanedioic acid;hydride
CID 173074924
(2S)-2-aminopentanedioic acid;benzene
CID 161035359

Frequently Asked Questions

What is the IUPAC name of 2-aminopentanedioic acid;piperidine?
The IUPAC name of 2-aminopentanedioic acid;piperidine (CID 19704542) is 2-aminopentanedioic acid;piperidine.
What is the SMILES notation for 2-aminopentanedioic acid;piperidine?
The canonical SMILES for 2-aminopentanedioic acid;piperidine is C1CCNCC1.NC(CCC(=O)O)C(=O)O.
What is the InChIKey of 2-aminopentanedioic acid;piperidine?
The InChIKey is JZUYQMYQLYTELG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO4.C5H11N/c6-3(5(9)10)1-2-4(7)8;1-2-4-6-5-3-1/h3H,1-2,6H2,(H,7,8)(H,9,10);6H,1-5H2.
What are the key properties of 2-aminopentanedioic acid;piperidine?
2-aminopentanedioic acid;piperidine has a molecular weight of 232.28 g/mol, XLogP of 0.02, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminopentanedioic acid;piperidine is sourced from PubChem (CID 19704542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).