1-ethyl-1-(2-hydroxyethyl)-3-(2-methoxyethoxymethyl)urea

C9H20N2O4 — CID 108894427

IUPAC1-ethyl-1-(2-hydroxyethyl)-3-(2-methoxyethoxymethyl)urea
SMILESCCN(CCO)C(=O)NCOCCOC
InChIInChI=1S/C9H20N2O4/c1-3-11(4-5-12)9(13)10-8-15-7-6-14-2/h12H,3-8H2,1-2H3,(H,10,13)
InChIKeyONIVFHPUSPNMHM-UHFFFAOYSA-N
MW220.27 g/mol
LogP-0.37
Rot. Bonds8

About 1-ethyl-1-(2-hydroxyethyl)-3-(2-methoxyethoxymethyl)urea

1-ethyl-1-(2-hydroxyethyl)-3-(2-methoxyethoxymethyl)urea (PubChem CID 108894427) has the molecular formula C9H20N2O4 and a molecular weight of 220.27 g/mol. Its IUPAC name is 1-ethyl-1-(2-hydroxyethyl)-3-(2-methoxyethoxymethyl)urea.

Molecular Properties

Compound Name1-ethyl-1-(2-hydroxyethyl)-3-(2-methoxyethoxymethyl)urea
PubChem CID108894427
Molecular FormulaC9H20N2O4
Molecular Weight220.27 g/mol
Exact Mass220.14
IUPAC Name1-ethyl-1-(2-hydroxyethyl)-3-(2-methoxyethoxymethyl)urea
SMILESCCN(CCO)C(=O)NCOCCOC
InChIInChI=1S/C9H20N2O4/c1-3-11(4-5-12)9(13)10-8-15-7-6-14-2/h12H,3-8H2,1-2H3,(H,10,13)
InChIKeyONIVFHPUSPNMHM-UHFFFAOYSA-N
XLogP-0.37
TPSA71.03 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 5-0.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

3-ethyl-1,1-bis(2-methoxyethyl)urea
CID 108890462
N-[2-(diethylcarbamoylamino)ethyl]-2-(2-methoxyethoxy)acetamide
CID 108574836
1,1,3-tris(butoxymethyl)urea
CID 89402141
4-[[ethyl(2-methoxyethyl)carbamoyl]amino]-2-hydroxybutanoic acid
CID 107838885
3-[ethyl-[2-[2-methoxyethyl(methyl)amino]ethylcarbamoyl]amino]propanoic acid
CID 62851164
7-[[ethyl(2-hydroxyethyl)carbamoyl]amino]heptanoic acid
CID 61207638
2-(tert-butylamino)-N-ethyl-N-(2-methoxyethyl)acetamide
CID 112727456
2-amino-N-ethyl-N-(2-hydroxyethyl)-5-methoxypentanamide
CID 81082966
1-ethyl-1-(2-hydroxyethyl)-3-[(4-hydroxyphenyl)methyl]urea
CID 110895646
1-ethyl-3-[(2-ethylphenyl)methyl]-1-(2-hydroxyethyl)urea
CID 111455825
1-ethyl-1-(2-methoxyethyl)-3,3-dimethylurea
CID 115590966
3-(diethylcarbamoylamino)-N-(2-methoxyethyl)propanamide
CID 113226661

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-1-(2-hydroxyethyl)-3-(2-methoxyethoxymethyl)urea?
The IUPAC name of 1-ethyl-1-(2-hydroxyethyl)-3-(2-methoxyethoxymethyl)urea (CID 108894427) is 1-ethyl-1-(2-hydroxyethyl)-3-(2-methoxyethoxymethyl)urea.
What is the SMILES notation for 1-ethyl-1-(2-hydroxyethyl)-3-(2-methoxyethoxymethyl)urea?
The canonical SMILES for 1-ethyl-1-(2-hydroxyethyl)-3-(2-methoxyethoxymethyl)urea is CCN(CCO)C(=O)NCOCCOC.
What is the InChIKey of 1-ethyl-1-(2-hydroxyethyl)-3-(2-methoxyethoxymethyl)urea?
The InChIKey is ONIVFHPUSPNMHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O4/c1-3-11(4-5-12)9(13)10-8-15-7-6-14-2/h12H,3-8H2,1-2H3,(H,10,13).
What are the key properties of 1-ethyl-1-(2-hydroxyethyl)-3-(2-methoxyethoxymethyl)urea?
1-ethyl-1-(2-hydroxyethyl)-3-(2-methoxyethoxymethyl)urea has a molecular weight of 220.27 g/mol, XLogP of -0.37, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-1-(2-hydroxyethyl)-3-(2-methoxyethoxymethyl)urea is sourced from PubChem (CID 108894427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).