2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyethylcarbamoyl)acetamide

C10H21N3O5 — CID 60686668

IUPAC2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyethylcarbamoyl)acetamide
SMILESCOCCNC(=O)NC(=O)CN(CCO)CCO
InChIInChI=1S/C10H21N3O5/c1-18-7-2-11-10(17)12-9(16)8-13(3-5-14)4-6-15/h14-15H,2-8H2,1H3,(H2,11,12,16,17)
InChIKeyONYQKUPQKGEVQI-UHFFFAOYSA-N
MW263.29 g/mol
LogP-2.25
Rot. Bonds9

About 2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyethylcarbamoyl)acetamide

2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyethylcarbamoyl)acetamide (PubChem CID 60686668) has the molecular formula C10H21N3O5 and a molecular weight of 263.29 g/mol. Its IUPAC name is 2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyethylcarbamoyl)acetamide.

Molecular Properties

Compound Name2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyethylcarbamoyl)acetamide
PubChem CID60686668
Molecular FormulaC10H21N3O5
Molecular Weight263.29 g/mol
Exact Mass263.15
IUPAC Name2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyethylcarbamoyl)acetamide
SMILESCOCCNC(=O)NC(=O)CN(CCO)CCO
InChIInChI=1S/C10H21N3O5/c1-18-7-2-11-10(17)12-9(16)8-13(3-5-14)4-6-15/h14-15H,2-8H2,1H3,(H2,11,12,16,17)
InChIKeyONYQKUPQKGEVQI-UHFFFAOYSA-N
XLogP-2.25
TPSA111.13 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.29
LogP ≤ 5-2.25
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-[ethyl(2-hydroxyethyl)amino]-N-(2-methoxyethylcarbamoyl)acetamide
CID 31994044
2-[bis(2-hydroxyethyl)amino]-N-(propylcarbamoyl)acetamide
CID 60686309
3-[2-hydroxyethyl-[2-(2-methoxyethylamino)-2-oxoethyl]amino]propanoic acid
CID 82327156
2-[[2-(2-methoxyethylcarbamoylamino)-2-oxoethyl]-propylamino]acetic acid
CID 61007591
2-[2-(dimethylamino)ethyl-[2-(2-methoxyethylcarbamoylamino)-2-oxoethyl]amino]acetic acid
CID 107425846
2-(2-hydroxyethylsulfanyl)-N-(2-methoxyethylcarbamoyl)acetamide
CID 43392468
2-[ethyl(3-hydroxypropyl)amino]-N-(2-methoxyethyl)acetamide
CID 115666547
2-[azetidin-3-yl(methyl)amino]-N-(2-methoxyethylcarbamoyl)acetamide
CID 66185736
2-hydroxy-N-(2-methoxyethyl)acetamide
CID 19987818
2-[bis(2-hydroxyethyl)amino]-N-propylacetamide
CID 60686308
N-(2-methoxyethylcarbamoyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide
CID 63304558
2-(2-hydroxyethylsulfonyl)-N-(2-methoxyethyl)acetamide
CID 82181706

Frequently Asked Questions

What is the IUPAC name of 2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyethylcarbamoyl)acetamide?
The IUPAC name of 2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyethylcarbamoyl)acetamide (CID 60686668) is 2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyethylcarbamoyl)acetamide.
What is the SMILES notation for 2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyethylcarbamoyl)acetamide?
The canonical SMILES for 2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyethylcarbamoyl)acetamide is COCCNC(=O)NC(=O)CN(CCO)CCO.
What is the InChIKey of 2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyethylcarbamoyl)acetamide?
The InChIKey is ONYQKUPQKGEVQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O5/c1-18-7-2-11-10(17)12-9(16)8-13(3-5-14)4-6-15/h14-15H,2-8H2,1H3,(H2,11,12,16,17).
What are the key properties of 2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyethylcarbamoyl)acetamide?
2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyethylcarbamoyl)acetamide has a molecular weight of 263.29 g/mol, XLogP of -2.25, 9 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyethylcarbamoyl)acetamide is sourced from PubChem (CID 60686668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).