(2-aminoethylamino) acetate;hydrochloride

C4H11ClN2O2 — CID 174583759

IUPAC(2-aminoethylamino) acetate;hydrochloride
SMILESCC(=O)ONCCN.Cl
InChIInChI=1S/C4H10N2O2.ClH/c1-4(7)8-6-3-2-5;/h6H,2-3,5H2,1H3;1H
InChIKeyHOZOBOLNRNHSRY-UHFFFAOYSA-N
MW154.60 g/mol
LogP-0.57
Rot. Bonds3

About (2-aminoethylamino) acetate;hydrochloride

(2-aminoethylamino) acetate;hydrochloride (PubChem CID 174583759) has the molecular formula C4H11ClN2O2 and a molecular weight of 154.60 g/mol. Its IUPAC name is (2-aminoethylamino) acetate;hydrochloride.

Molecular Properties

Compound Name(2-aminoethylamino) acetate;hydrochloride
PubChem CID174583759
Molecular FormulaC4H11ClN2O2
Molecular Weight154.60 g/mol
Exact Mass154.05
IUPAC Name(2-aminoethylamino) acetate;hydrochloride
SMILESCC(=O)ONCCN.Cl
InChIInChI=1S/C4H10N2O2.ClH/c1-4(7)8-6-3-2-5;/h6H,2-3,5H2,1H3;1H
InChIKeyHOZOBOLNRNHSRY-UHFFFAOYSA-N
XLogP-0.57
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.60
LogP ≤ 5-0.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(2-aminoethylamino) acetate;chromium
CID 88783044
disodium;(2-aminoethylamino) acetate;hydride
CID 173366093
(2-aminoethylamino) acetate;cadmium;dihydrate
CID 174988758
(2-aminoethylamino) N-aminocarbamate
CID 174871175
4-O-(2-aminoethylamino) 1-O-methyl (E)-but-2-enedioate
CID 130312327
2-(2-aminoethylamino)oxy-2-oxoacetic acid;silver
CID 87556707
N'-(2-aminoethyl)ethane-1,2-diamine;ethaneperoxoic acid
CID 157318736
bis(2-aminoethylamino) nonanedioate
CID 88731142
acetic acid;N'-[2-[2-(2-aminoethylamino)ethylamino]ethyl]ethane-1,2-diamine
CID 159794226
acetic acid;N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine
CID 30081
CID 160895097
CID 160895097
(2-aminoethylamino) octadecanoate
CID 87496709

Frequently Asked Questions

What is the IUPAC name of (2-aminoethylamino) acetate;hydrochloride?
The IUPAC name of (2-aminoethylamino) acetate;hydrochloride (CID 174583759) is (2-aminoethylamino) acetate;hydrochloride.
What is the SMILES notation for (2-aminoethylamino) acetate;hydrochloride?
The canonical SMILES for (2-aminoethylamino) acetate;hydrochloride is CC(=O)ONCCN.Cl.
What is the InChIKey of (2-aminoethylamino) acetate;hydrochloride?
The InChIKey is HOZOBOLNRNHSRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2O2.ClH/c1-4(7)8-6-3-2-5;/h6H,2-3,5H2,1H3;1H.
What are the key properties of (2-aminoethylamino) acetate;hydrochloride?
(2-aminoethylamino) acetate;hydrochloride has a molecular weight of 154.60 g/mol, XLogP of -0.57, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-aminoethylamino) acetate;hydrochloride is sourced from PubChem (CID 174583759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).