2-[2-[2-(2-amino-2-oxoethoxy)ethylamino]-2-oxoethoxy]acetic acid

C8H14N2O6 — CID 106234757

IUPAC2-[2-[2-(2-amino-2-oxoethoxy)ethylamino]-2-oxoethoxy]acetic acid
SMILESNC(=O)COCCNC(=O)COCC(=O)O
InChIInChI=1S/C8H14N2O6/c9-6(11)3-15-2-1-10-7(12)4-16-5-8(13)14/h1-5H2,(H2,9,11)(H,10,12)(H,13,14)
InChIKeyMKCIPCJHZCCCIP-UHFFFAOYSA-N
MW234.21 g/mol
LogP-2.29
Rot. Bonds9

About 2-[2-[2-(2-amino-2-oxoethoxy)ethylamino]-2-oxoethoxy]acetic acid

2-[2-[2-(2-amino-2-oxoethoxy)ethylamino]-2-oxoethoxy]acetic acid (PubChem CID 106234757) has the molecular formula C8H14N2O6 and a molecular weight of 234.21 g/mol. Its IUPAC name is 2-[2-[2-(2-amino-2-oxoethoxy)ethylamino]-2-oxoethoxy]acetic acid.

Molecular Properties

Compound Name2-[2-[2-(2-amino-2-oxoethoxy)ethylamino]-2-oxoethoxy]acetic acid
PubChem CID106234757
Molecular FormulaC8H14N2O6
Molecular Weight234.21 g/mol
Exact Mass234.09
IUPAC Name2-[2-[2-(2-amino-2-oxoethoxy)ethylamino]-2-oxoethoxy]acetic acid
SMILESNC(=O)COCCNC(=O)COCC(=O)O
InChIInChI=1S/C8H14N2O6/c9-6(11)3-15-2-1-10-7(12)4-16-5-8(13)14/h1-5H2,(H2,9,11)(H,10,12)(H,13,14)
InChIKeyMKCIPCJHZCCCIP-UHFFFAOYSA-N
XLogP-2.29
TPSA127.95 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.21
LogP ≤ 5-2.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[[2-(2-methoxyethoxy)acetyl]amino]ethoxy]acetamide
CID 103767893
2-[3-[2-[[2-[3-[2-[[2-[3-[2-[[2-[2-(2-hydrazinylethoxy)ethoxy]acetyl]amino]ethoxy]propoxy]acetyl]amino]ethoxy]propoxy]acetyl]amino]ethoxy]propoxy]acetamide
CID 123291674
2-[2-[6-[[2-(carboxymethoxy)acetyl]amino]hexylamino]-2-oxoethoxy]acetic acid
CID 88852782
2-[[2-[2-[2-[[2-[2-[2-[(4-amino-4-oxobutanoyl)amino]ethoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetyl]amino]acetic acid
CID 123723639
2-[2-[2-[(2-chloroacetyl)amino]ethoxy]ethoxy]acetic acid
CID 163273323
2-[2-(5-aminopentanoylamino)ethoxy]acetic acid
CID 79457859
N-[2-(2-amino-2-oxoethoxy)ethyl]-2-(ethylamino)acetamide
CID 106236362
2-[2-(hexadecanoylamino)ethoxy]acetic acid
CID 3017701
6-amino-N-[2-(2-amino-2-oxoethoxy)ethyl]hexanamide
CID 106236522
5-[2-(2-amino-2-oxoethoxy)ethylcarbamoylamino]pentanoic acid
CID 114162551
2-[2-[2-[2-[2-(carboxyamino)ethoxy]ethoxy]ethoxy]ethoxy]acetic acid
CID 86346270
N-[2-(2-aminoethoxy)ethyl]-2-propoxyacetamide
CID 107941598

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-(2-amino-2-oxoethoxy)ethylamino]-2-oxoethoxy]acetic acid?
The IUPAC name of 2-[2-[2-(2-amino-2-oxoethoxy)ethylamino]-2-oxoethoxy]acetic acid (CID 106234757) is 2-[2-[2-(2-amino-2-oxoethoxy)ethylamino]-2-oxoethoxy]acetic acid.
What is the SMILES notation for 2-[2-[2-(2-amino-2-oxoethoxy)ethylamino]-2-oxoethoxy]acetic acid?
The canonical SMILES for 2-[2-[2-(2-amino-2-oxoethoxy)ethylamino]-2-oxoethoxy]acetic acid is NC(=O)COCCNC(=O)COCC(=O)O.
What is the InChIKey of 2-[2-[2-(2-amino-2-oxoethoxy)ethylamino]-2-oxoethoxy]acetic acid?
The InChIKey is MKCIPCJHZCCCIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O6/c9-6(11)3-15-2-1-10-7(12)4-16-5-8(13)14/h1-5H2,(H2,9,11)(H,10,12)(H,13,14).
What are the key properties of 2-[2-[2-(2-amino-2-oxoethoxy)ethylamino]-2-oxoethoxy]acetic acid?
2-[2-[2-(2-amino-2-oxoethoxy)ethylamino]-2-oxoethoxy]acetic acid has a molecular weight of 234.21 g/mol, XLogP of -2.29, 9 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(2-amino-2-oxoethoxy)ethylamino]-2-oxoethoxy]acetic acid is sourced from PubChem (CID 106234757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).