2-(2-morpholin-4-ylethylamino)acetic acid

C8H16N2O3 — CID 28897547

IUPAC2-(2-morpholin-4-ylethylamino)acetic acid
SMILESO=C(O)CNCCN1CCOCC1
InChIInChI=1S/C8H16N2O3/c11-8(12)7-9-1-2-10-3-5-13-6-4-10/h9H,1-7H2,(H,11,12)
InChIKeyOXUYRKQXXRBONI-UHFFFAOYSA-N
MW188.23 g/mol
LogP-1.01
Rot. Bonds5

About 2-(2-morpholin-4-ylethylamino)acetic acid

2-(2-morpholin-4-ylethylamino)acetic acid (PubChem CID 28897547) has the molecular formula C8H16N2O3 and a molecular weight of 188.23 g/mol. Its IUPAC name is 2-(2-morpholin-4-ylethylamino)acetic acid.

Molecular Properties

Compound Name2-(2-morpholin-4-ylethylamino)acetic acid
PubChem CID28897547
Molecular FormulaC8H16N2O3
Molecular Weight188.23 g/mol
Exact Mass188.12
IUPAC Name2-(2-morpholin-4-ylethylamino)acetic acid
SMILESO=C(O)CNCCN1CCOCC1
InChIInChI=1S/C8H16N2O3/c11-8(12)7-9-1-2-10-3-5-13-6-4-10/h9H,1-7H2,(H,11,12)
InChIKeyOXUYRKQXXRBONI-UHFFFAOYSA-N
XLogP-1.01
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 5-1.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2-morpholin-4-ylethylamino)acetic acid?
The IUPAC name of 2-(2-morpholin-4-ylethylamino)acetic acid (CID 28897547) is 2-(2-morpholin-4-ylethylamino)acetic acid.
What is the SMILES notation for 2-(2-morpholin-4-ylethylamino)acetic acid?
The canonical SMILES for 2-(2-morpholin-4-ylethylamino)acetic acid is O=C(O)CNCCN1CCOCC1.
What is the InChIKey of 2-(2-morpholin-4-ylethylamino)acetic acid?
The InChIKey is OXUYRKQXXRBONI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O3/c11-8(12)7-9-1-2-10-3-5-13-6-4-10/h9H,1-7H2,(H,11,12).
What are the key properties of 2-(2-morpholin-4-ylethylamino)acetic acid?
2-(2-morpholin-4-ylethylamino)acetic acid has a molecular weight of 188.23 g/mol, XLogP of -1.01, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-morpholin-4-ylethylamino)acetic acid is sourced from PubChem (CID 28897547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).