1-ethyl-1-(2-methoxyethyl)-3,3-dimethylurea

C8H18N2O2 — CID 115590966

IUPAC1-ethyl-1-(2-methoxyethyl)-3,3-dimethylurea
SMILESCCN(CCOC)C(=O)N(C)C
InChIInChI=1S/C8H18N2O2/c1-5-10(6-7-12-4)8(11)9(2)3/h5-7H2,1-4H3
InChIKeyFOICJTRDFNXCRY-UHFFFAOYSA-N
MW174.24 g/mol
LogP0.64
Rot. Bonds4

About 1-ethyl-1-(2-methoxyethyl)-3,3-dimethylurea

1-ethyl-1-(2-methoxyethyl)-3,3-dimethylurea (PubChem CID 115590966) has the molecular formula C8H18N2O2 and a molecular weight of 174.24 g/mol. Its IUPAC name is 1-ethyl-1-(2-methoxyethyl)-3,3-dimethylurea.

Molecular Properties

Compound Name1-ethyl-1-(2-methoxyethyl)-3,3-dimethylurea
PubChem CID115590966
Molecular FormulaC8H18N2O2
Molecular Weight174.24 g/mol
Exact Mass174.14
IUPAC Name1-ethyl-1-(2-methoxyethyl)-3,3-dimethylurea
SMILESCCN(CCOC)C(=O)N(C)C
InChIInChI=1S/C8H18N2O2/c1-5-10(6-7-12-4)8(11)9(2)3/h5-7H2,1-4H3
InChIKeyFOICJTRDFNXCRY-UHFFFAOYSA-N
XLogP0.64
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.24
LogP ≤ 50.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-1-(2-methoxyethyl)-3,3-dimethylurea?
The IUPAC name of 1-ethyl-1-(2-methoxyethyl)-3,3-dimethylurea (CID 115590966) is 1-ethyl-1-(2-methoxyethyl)-3,3-dimethylurea.
What is the SMILES notation for 1-ethyl-1-(2-methoxyethyl)-3,3-dimethylurea?
The canonical SMILES for 1-ethyl-1-(2-methoxyethyl)-3,3-dimethylurea is CCN(CCOC)C(=O)N(C)C.
What is the InChIKey of 1-ethyl-1-(2-methoxyethyl)-3,3-dimethylurea?
The InChIKey is FOICJTRDFNXCRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O2/c1-5-10(6-7-12-4)8(11)9(2)3/h5-7H2,1-4H3.
What are the key properties of 1-ethyl-1-(2-methoxyethyl)-3,3-dimethylurea?
1-ethyl-1-(2-methoxyethyl)-3,3-dimethylurea has a molecular weight of 174.24 g/mol, XLogP of 0.64, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-1-(2-methoxyethyl)-3,3-dimethylurea is sourced from PubChem (CID 115590966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).