tert-butyl 2-[(2-aminoacetyl)amino]acetate

C8H16N2O3 — CID 15403805

IUPACtert-butyl 2-[(2-aminoacetyl)amino]acetate
SMILESCC(C)(C)OC(=O)CNC(=O)CN
InChIInChI=1S/C8H16N2O3/c1-8(2,3)13-7(12)5-10-6(11)4-9/h4-5,9H2,1-3H3,(H,10,11)
InChIKeyVJEYRLMJNBJAHS-UHFFFAOYSA-N
MW188.23 g/mol
LogP-0.60
Rot. Bonds3

About tert-butyl 2-[(2-aminoacetyl)amino]acetate

tert-butyl 2-[(2-aminoacetyl)amino]acetate (PubChem CID 15403805) has the molecular formula C8H16N2O3 and a molecular weight of 188.23 g/mol. Its IUPAC name is tert-butyl 2-[(2-aminoacetyl)amino]acetate.

Molecular Properties

Compound Nametert-butyl 2-[(2-aminoacetyl)amino]acetate
PubChem CID15403805
Molecular FormulaC8H16N2O3
Molecular Weight188.23 g/mol
Exact Mass188.12
IUPAC Nametert-butyl 2-[(2-aminoacetyl)amino]acetate
SMILESCC(C)(C)OC(=O)CNC(=O)CN
InChIInChI=1S/C8H16N2O3/c1-8(2,3)13-7(12)5-10-6(11)4-9/h4-5,9H2,1-3H3,(H,10,11)
InChIKeyVJEYRLMJNBJAHS-UHFFFAOYSA-N
XLogP-0.60
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 5-0.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-[(2-aminoacetyl)amino]acetate;hydrochloride
CID 13029724
tert-butyl 2-aminoacetate;ethane
CID 143116857
tert-butyl 2-(3-methoxypropanoylamino)acetate
CID 173312753
tert-butyl N-[3-[(2-aminoacetyl)amino]propyl]carbamate
CID 23591745
tert-butyl 2-(but-3-enoylamino)acetate
CID 13110976
ethyl 2-[[2-[(2-aminoacetyl)amino]acetyl]amino]acetate
CID 7020070
tert-butyl 2-[[2-(prop-2-enoxycarbonylamino)acetyl]amino]acetate
CID 11097680
tert-butyl N-[[2-[(2-aminoacetyl)amino]acetyl]amino]-N-ethoxycarbamate
CID 174997154
tert-butyl 2-(methylamino)acetate;hydrochloride
CID 11252350
tert-butyl 2-(methylamino)acetate;ethane
CID 143004820
ethyl 2-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]-2-oxoacetate
CID 91619483
2-amino-N-[2-[3-[(2-methylpropan-2-yl)oxy]propylamino]-2-oxoethyl]acetamide
CID 147267401

Frequently Asked Questions

What is the IUPAC name of tert-butyl 2-[(2-aminoacetyl)amino]acetate?
The IUPAC name of tert-butyl 2-[(2-aminoacetyl)amino]acetate (CID 15403805) is tert-butyl 2-[(2-aminoacetyl)amino]acetate.
What is the SMILES notation for tert-butyl 2-[(2-aminoacetyl)amino]acetate?
The canonical SMILES for tert-butyl 2-[(2-aminoacetyl)amino]acetate is CC(C)(C)OC(=O)CNC(=O)CN.
What is the InChIKey of tert-butyl 2-[(2-aminoacetyl)amino]acetate?
The InChIKey is VJEYRLMJNBJAHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O3/c1-8(2,3)13-7(12)5-10-6(11)4-9/h4-5,9H2,1-3H3,(H,10,11).
What are the key properties of tert-butyl 2-[(2-aminoacetyl)amino]acetate?
tert-butyl 2-[(2-aminoacetyl)amino]acetate has a molecular weight of 188.23 g/mol, XLogP of -0.60, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 2-[(2-aminoacetyl)amino]acetate is sourced from PubChem (CID 15403805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).