2-[2-methoxyethyl(oxan-3-ylcarbamoyl)amino]acetic acid

C11H20N2O5 — CID 79270376

IUPAC2-[2-methoxyethyl(oxan-3-ylcarbamoyl)amino]acetic acid
SMILESCOCCN(CC(=O)O)C(=O)NC1CCCOC1
InChIInChI=1S/C11H20N2O5/c1-17-6-4-13(7-10(14)15)11(16)12-9-3-2-5-18-8-9/h9H,2-8H2,1H3,(H,12,16)(H,14,15)
InChIKeyNWTXSYRUXWGDNL-UHFFFAOYSA-N
MW260.29 g/mol
LogP-0.09
Rot. Bonds6

About 2-[2-methoxyethyl(oxan-3-ylcarbamoyl)amino]acetic acid

2-[2-methoxyethyl(oxan-3-ylcarbamoyl)amino]acetic acid (PubChem CID 79270376) has the molecular formula C11H20N2O5 and a molecular weight of 260.29 g/mol. Its IUPAC name is 2-[2-methoxyethyl(oxan-3-ylcarbamoyl)amino]acetic acid.

Molecular Properties

Compound Name2-[2-methoxyethyl(oxan-3-ylcarbamoyl)amino]acetic acid
PubChem CID79270376
Molecular FormulaC11H20N2O5
Molecular Weight260.29 g/mol
Exact Mass260.14
IUPAC Name2-[2-methoxyethyl(oxan-3-ylcarbamoyl)amino]acetic acid
SMILESCOCCN(CC(=O)O)C(=O)NC1CCCOC1
InChIInChI=1S/C11H20N2O5/c1-17-6-4-13(7-10(14)15)11(16)12-9-3-2-5-18-8-9/h9H,2-8H2,1H3,(H,12,16)(H,14,15)
InChIKeyNWTXSYRUXWGDNL-UHFFFAOYSA-N
XLogP-0.09
TPSA88.10 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[cyclobutylcarbamoyl(2-methoxyethyl)amino]acetic acid
CID 79269687
2-[cycloheptylcarbamoyl(2-methoxyethyl)amino]acetic acid
CID 79271342
2-[(3,4-dimethylcyclohexyl)carbamoyl-(2-methoxyethyl)amino]acetic acid
CID 79272291
3-[methyl(oxan-3-ylcarbamoyl)amino]propanoic acid
CID 63361423
1-(2-methoxyethyl)-3-(oxolan-3-yl)-1-(pyrrolidin-2-ylmethyl)urea
CID 106613461
2-[2-methoxyethyl-(3-methylmorpholine-4-carbonyl)amino]acetic acid
CID 79271907
2-[(2,3-dimethylcyclohexyl)carbamoyl-(2-methoxyethyl)amino]acetic acid
CID 79272617
2-[cyclopropylmethylcarbamoyl(2-methoxyethyl)amino]acetic acid
CID 79269872
ethyl 2-[cyclohexylcarbamoyl(2-methoxyethyl)amino]acetate
CID 115585865
2-[oxan-4-ylcarbamoyl(propyl)amino]acetic acid
CID 55032022
3-cyclohexyl-1-(2-methoxyethyl)-1-[(4-methyloxan-4-yl)methyl]urea
CID 71686959
2-[2-methoxyethyl-[3-(oxolan-2-ylmethoxy)propanoyl]amino]acetic acid
CID 119189387

Frequently Asked Questions

What is the IUPAC name of 2-[2-methoxyethyl(oxan-3-ylcarbamoyl)amino]acetic acid?
The IUPAC name of 2-[2-methoxyethyl(oxan-3-ylcarbamoyl)amino]acetic acid (CID 79270376) is 2-[2-methoxyethyl(oxan-3-ylcarbamoyl)amino]acetic acid.
What is the SMILES notation for 2-[2-methoxyethyl(oxan-3-ylcarbamoyl)amino]acetic acid?
The canonical SMILES for 2-[2-methoxyethyl(oxan-3-ylcarbamoyl)amino]acetic acid is COCCN(CC(=O)O)C(=O)NC1CCCOC1.
What is the InChIKey of 2-[2-methoxyethyl(oxan-3-ylcarbamoyl)amino]acetic acid?
The InChIKey is NWTXSYRUXWGDNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O5/c1-17-6-4-13(7-10(14)15)11(16)12-9-3-2-5-18-8-9/h9H,2-8H2,1H3,(H,12,16)(H,14,15).
What are the key properties of 2-[2-methoxyethyl(oxan-3-ylcarbamoyl)amino]acetic acid?
2-[2-methoxyethyl(oxan-3-ylcarbamoyl)amino]acetic acid has a molecular weight of 260.29 g/mol, XLogP of -0.09, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methoxyethyl(oxan-3-ylcarbamoyl)amino]acetic acid is sourced from PubChem (CID 79270376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).