1-ethoxy-3-(2-methoxyethyl)urea

C6H14N2O3 — CID 146345452

IUPAC1-ethoxy-3-(2-methoxyethyl)urea
SMILESCCONC(=O)NCCOC
InChIInChI=1S/C6H14N2O3/c1-3-11-8-6(9)7-4-5-10-2/h3-5H2,1-2H3,(H2,7,8,9)
InChIKeyVNHKHQNFDBRKLK-UHFFFAOYSA-N
MW162.19 g/mol
LogP-0.12
Rot. Bonds5

About 1-ethoxy-3-(2-methoxyethyl)urea

1-ethoxy-3-(2-methoxyethyl)urea (PubChem CID 146345452) has the molecular formula C6H14N2O3 and a molecular weight of 162.19 g/mol. Its IUPAC name is 1-ethoxy-3-(2-methoxyethyl)urea.

Molecular Properties

Compound Name1-ethoxy-3-(2-methoxyethyl)urea
PubChem CID146345452
Molecular FormulaC6H14N2O3
Molecular Weight162.19 g/mol
Exact Mass162.10
IUPAC Name1-ethoxy-3-(2-methoxyethyl)urea
SMILESCCONC(=O)NCCOC
InChIInChI=1S/C6H14N2O3/c1-3-11-8-6(9)7-4-5-10-2/h3-5H2,1-2H3,(H2,7,8,9)
InChIKeyVNHKHQNFDBRKLK-UHFFFAOYSA-N
XLogP-0.12
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.19
LogP ≤ 5-0.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-ethoxy-3-(methoxymethyl)urea
CID 146345453
1-(2-methoxyethyl)-3-pentan-3-ylurea
CID 108888239
ethyl N-[2-(2-methoxyethoxymethylcarbamoylamino)ethyl]carbamate
CID 108894606
N-[4-(2-methoxyethylcarbamoylamino)butyl]acetamide
CID 110415978
N-[3-(2-methoxyethylamino)-3-oxopropyl]butanamide
CID 115590611
2-methoxyethyl N-[2-(2-methoxyethoxycarbonylamino)ethyl]carbamate
CID 118910846
2-amino-N-(2-methoxyethyl)propanamide
CID 24703832
N-(2-methoxyethyl)-2-oxobutanamide
CID 141125375
ethyl 4-(2-methoxyethylcarbamoylamino)benzoate
CID 47146237
2-(butylcarbamoylamino)-N-(2-methoxyethyl)acetamide
CID 115574241
2-hydroxy-N-(2-methoxyethyl)acetamide
CID 19987818
ethyl N-[2-(methoxymethylcarbamoylamino)ethyl]carbamate
CID 108893697

Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-3-(2-methoxyethyl)urea?
The IUPAC name of 1-ethoxy-3-(2-methoxyethyl)urea (CID 146345452) is 1-ethoxy-3-(2-methoxyethyl)urea.
What is the SMILES notation for 1-ethoxy-3-(2-methoxyethyl)urea?
The canonical SMILES for 1-ethoxy-3-(2-methoxyethyl)urea is CCONC(=O)NCCOC.
What is the InChIKey of 1-ethoxy-3-(2-methoxyethyl)urea?
The InChIKey is VNHKHQNFDBRKLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O3/c1-3-11-8-6(9)7-4-5-10-2/h3-5H2,1-2H3,(H2,7,8,9).
What are the key properties of 1-ethoxy-3-(2-methoxyethyl)urea?
1-ethoxy-3-(2-methoxyethyl)urea has a molecular weight of 162.19 g/mol, XLogP of -0.12, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-3-(2-methoxyethyl)urea is sourced from PubChem (CID 146345452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).