2-[[2-[[2-methoxyethyl(propan-2-yl)carbamoyl]amino]acetyl]amino]acetic acid

C11H21N3O5 — CID 82951795

IUPAC2-[[2-[[2-methoxyethyl(propan-2-yl)carbamoyl]amino]acetyl]amino]acetic acid
SMILESCOCCN(C(=O)NCC(=O)NCC(=O)O)C(C)C
InChIInChI=1S/C11H21N3O5/c1-8(2)14(4-5-19-3)11(18)13-6-9(15)12-7-10(16)17/h8H,4-7H2,1-3H3,(H,12,15)(H,13,18)(H,16,17)
InChIKeyDEYSLNXEAIUVRM-UHFFFAOYSA-N
MW275.31 g/mol
LogP-0.75
Rot. Bonds8

About 2-[[2-[[2-methoxyethyl(propan-2-yl)carbamoyl]amino]acetyl]amino]acetic acid

2-[[2-[[2-methoxyethyl(propan-2-yl)carbamoyl]amino]acetyl]amino]acetic acid (PubChem CID 82951795) has the molecular formula C11H21N3O5 and a molecular weight of 275.31 g/mol. Its IUPAC name is 2-[[2-[[2-methoxyethyl(propan-2-yl)carbamoyl]amino]acetyl]amino]acetic acid.

Molecular Properties

Compound Name2-[[2-[[2-methoxyethyl(propan-2-yl)carbamoyl]amino]acetyl]amino]acetic acid
PubChem CID82951795
Molecular FormulaC11H21N3O5
Molecular Weight275.31 g/mol
Exact Mass275.15
IUPAC Name2-[[2-[[2-methoxyethyl(propan-2-yl)carbamoyl]amino]acetyl]amino]acetic acid
SMILESCOCCN(C(=O)NCC(=O)NCC(=O)O)C(C)C
InChIInChI=1S/C11H21N3O5/c1-8(2)14(4-5-19-3)11(18)13-6-9(15)12-7-10(16)17/h8H,4-7H2,1-3H3,(H,12,15)(H,13,18)(H,16,17)
InChIKeyDEYSLNXEAIUVRM-UHFFFAOYSA-N
XLogP-0.75
TPSA107.97 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 5-0.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-[[2-[[2-methoxyethyl(propan-2-yl)carbamoyl]amino]acetyl]amino]acetic acid with MolForge

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Related Compounds

3-[[2-oxo-2-(propan-2-ylamino)ethyl]carbamoyl-propan-2-ylamino]propanoic acid
CID 61203436
2-[[2-[[(2-hydroxy-3-methoxypropyl)-methylcarbamoyl]amino]acetyl]amino]acetic acid
CID 54999225
3-hydroxy-2-[[2-methoxyethyl(propan-2-yl)carbamoyl]amino]propanoic acid
CID 82951243
2-[[2-[[2-(2-methoxyethylsulfanyl)acetyl]amino]acetyl]amino]acetic acid
CID 43465329
2-cyclopropyl-2-[[2-methoxyethyl(propan-2-yl)carbamoyl]amino]acetic acid
CID 82951883
3-[[2-methoxyethyl(propan-2-yl)carbamoyl]amino]hexanoic acid
CID 82951881
2-[[[2-methoxyethyl(propan-2-yl)carbamoyl]amino]methyl]cyclopentane-1-carboxylic acid
CID 82951994
2-[[2-[2-[methyl(propan-2-yl)amino]ethylcarbamoylamino]acetyl]amino]acetic acid
CID 62635691
4-[[2-[2-[2-methoxyethyl(methyl)amino]ethylamino]-2-oxoethyl]amino]-4-oxobutanoic acid
CID 129046478
N-(2-methoxyethyl)-N-propan-2-ylcarbamoyl chloride
CID 82966552
N-(2-methoxyethyl)-3-oxo-N-propan-2-ylbutanamide
CID 82948688
2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-(methoxycarbonylamino)acetyl]amino]acetyl]amino]acetyl]amino]acetyl]amino]acetyl]amino]acetyl]amino]acetyl]amino]acetyl]amino]acetyl]amino]acetyl]amino]acetic acid
CID 87757746

Frequently Asked Questions

What is the IUPAC name of 2-[[2-[[2-methoxyethyl(propan-2-yl)carbamoyl]amino]acetyl]amino]acetic acid?
The IUPAC name of 2-[[2-[[2-methoxyethyl(propan-2-yl)carbamoyl]amino]acetyl]amino]acetic acid (CID 82951795) is 2-[[2-[[2-methoxyethyl(propan-2-yl)carbamoyl]amino]acetyl]amino]acetic acid.
What is the SMILES notation for 2-[[2-[[2-methoxyethyl(propan-2-yl)carbamoyl]amino]acetyl]amino]acetic acid?
The canonical SMILES for 2-[[2-[[2-methoxyethyl(propan-2-yl)carbamoyl]amino]acetyl]amino]acetic acid is COCCN(C(=O)NCC(=O)NCC(=O)O)C(C)C.
What is the InChIKey of 2-[[2-[[2-methoxyethyl(propan-2-yl)carbamoyl]amino]acetyl]amino]acetic acid?
The InChIKey is DEYSLNXEAIUVRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O5/c1-8(2)14(4-5-19-3)11(18)13-6-9(15)12-7-10(16)17/h8H,4-7H2,1-3H3,(H,12,15)(H,13,18)(H,16,17).
What are the key properties of 2-[[2-[[2-methoxyethyl(propan-2-yl)carbamoyl]amino]acetyl]amino]acetic acid?
2-[[2-[[2-methoxyethyl(propan-2-yl)carbamoyl]amino]acetyl]amino]acetic acid has a molecular weight of 275.31 g/mol, XLogP of -0.75, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[[2-methoxyethyl(propan-2-yl)carbamoyl]amino]acetyl]amino]acetic acid is sourced from PubChem (CID 82951795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).