2-amino-2-(morpholine-4-carbonyl)pentanoic acid

C10H18N2O4 — CID 150274457

IUPAC2-amino-2-(morpholine-4-carbonyl)pentanoic acid
SMILESCCCC(N)(C(=O)O)C(=O)N1CCOCC1
InChIInChI=1S/C10H18N2O4/c1-2-3-10(11,9(14)15)8(13)12-4-6-16-7-5-12/h2-7,11H2,1H3,(H,14,15)
InChIKeyGEGJEARIYOJOKU-UHFFFAOYSA-N
MW230.26 g/mol
LogP-0.57
Rot. Bonds4

About 2-amino-2-(morpholine-4-carbonyl)pentanoic acid

2-amino-2-(morpholine-4-carbonyl)pentanoic acid (PubChem CID 150274457) has the molecular formula C10H18N2O4 and a molecular weight of 230.26 g/mol. Its IUPAC name is 2-amino-2-(morpholine-4-carbonyl)pentanoic acid.

Molecular Properties

Compound Name2-amino-2-(morpholine-4-carbonyl)pentanoic acid
PubChem CID150274457
Molecular FormulaC10H18N2O4
Molecular Weight230.26 g/mol
Exact Mass230.13
IUPAC Name2-amino-2-(morpholine-4-carbonyl)pentanoic acid
SMILESCCCC(N)(C(=O)O)C(=O)N1CCOCC1
InChIInChI=1S/C10H18N2O4/c1-2-3-10(11,9(14)15)8(13)12-4-6-16-7-5-12/h2-7,11H2,1H3,(H,14,15)
InChIKeyGEGJEARIYOJOKU-UHFFFAOYSA-N
XLogP-0.57
TPSA92.86 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.26
LogP ≤ 5-0.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(morpholine-4-carbonyl)pentanoic acid?
The IUPAC name of 2-amino-2-(morpholine-4-carbonyl)pentanoic acid (CID 150274457) is 2-amino-2-(morpholine-4-carbonyl)pentanoic acid.
What is the SMILES notation for 2-amino-2-(morpholine-4-carbonyl)pentanoic acid?
The canonical SMILES for 2-amino-2-(morpholine-4-carbonyl)pentanoic acid is CCCC(N)(C(=O)O)C(=O)N1CCOCC1.
What is the InChIKey of 2-amino-2-(morpholine-4-carbonyl)pentanoic acid?
The InChIKey is GEGJEARIYOJOKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O4/c1-2-3-10(11,9(14)15)8(13)12-4-6-16-7-5-12/h2-7,11H2,1H3,(H,14,15).
What are the key properties of 2-amino-2-(morpholine-4-carbonyl)pentanoic acid?
2-amino-2-(morpholine-4-carbonyl)pentanoic acid has a molecular weight of 230.26 g/mol, XLogP of -0.57, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(morpholine-4-carbonyl)pentanoic acid is sourced from PubChem (CID 150274457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).