1-(2-ethoxyethyl)-3,3-diethyl-1-methylurea

C10H22N2O2 — CID 115887200

IUPAC1-(2-ethoxyethyl)-3,3-diethyl-1-methylurea
SMILESCCOCCN(C)C(=O)N(CC)CC
InChIInChI=1S/C10H22N2O2/c1-5-12(6-2)10(13)11(4)8-9-14-7-3/h5-9H2,1-4H3
InChIKeyTWCDTLZCQCROBJ-UHFFFAOYSA-N
MW202.30 g/mol
LogP1.42
Rot. Bonds6

About 1-(2-ethoxyethyl)-3,3-diethyl-1-methylurea

1-(2-ethoxyethyl)-3,3-diethyl-1-methylurea (PubChem CID 115887200) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 1-(2-ethoxyethyl)-3,3-diethyl-1-methylurea.

Molecular Properties

Compound Name1-(2-ethoxyethyl)-3,3-diethyl-1-methylurea
PubChem CID115887200
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC Name1-(2-ethoxyethyl)-3,3-diethyl-1-methylurea
SMILESCCOCCN(C)C(=O)N(CC)CC
InChIInChI=1S/C10H22N2O2/c1-5-12(6-2)10(13)11(4)8-9-14-7-3/h5-9H2,1-4H3
InChIKeyTWCDTLZCQCROBJ-UHFFFAOYSA-N
XLogP1.42
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[carboxymethyl-[2-ethoxyethyl(methyl)carbamoyl]amino]acetic acid
CID 81057647
1,1,3,3-tetrakis(2-ethoxyethyl)urea
CID 54341985
2-[[2-ethoxyethyl(methyl)carbamoyl]-methylamino]butanoic acid
CID 81058123
2-[[2-ethoxyethyl(methyl)carbamoyl]-prop-2-ynylamino]acetic acid
CID 81056729
2-[2-ethoxyethyl(methyl)amino]-2-oxoacetic acid
CID 81061794
N-(2-ethoxyethyl)-N,2-dimethylpropanamide
CID 11423854
2-[[2-ethoxyethyl(ethyl)carbamoyl]-ethylamino]acetic acid
CID 63692727
3-amino-N-(2-ethoxyethyl)-N-methylpropanamide
CID 81058300
N-(2-ethoxyethyl)-N-ethyl-2-(methylamino)acetamide
CID 63691454
4-chloro-N-(2-ethoxyethyl)-N-methylbutanamide
CID 81059200
N-(2-ethoxyethyl)-2-methoxy-N,2-dimethylpropanamide
CID 103896451
N-(2-ethoxyethyl)-N-methyl-3-(methylamino)propanamide
CID 81058236

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxyethyl)-3,3-diethyl-1-methylurea?
The IUPAC name of 1-(2-ethoxyethyl)-3,3-diethyl-1-methylurea (CID 115887200) is 1-(2-ethoxyethyl)-3,3-diethyl-1-methylurea.
What is the SMILES notation for 1-(2-ethoxyethyl)-3,3-diethyl-1-methylurea?
The canonical SMILES for 1-(2-ethoxyethyl)-3,3-diethyl-1-methylurea is CCOCCN(C)C(=O)N(CC)CC.
What is the InChIKey of 1-(2-ethoxyethyl)-3,3-diethyl-1-methylurea?
The InChIKey is TWCDTLZCQCROBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2/c1-5-12(6-2)10(13)11(4)8-9-14-7-3/h5-9H2,1-4H3.
What are the key properties of 1-(2-ethoxyethyl)-3,3-diethyl-1-methylurea?
1-(2-ethoxyethyl)-3,3-diethyl-1-methylurea has a molecular weight of 202.30 g/mol, XLogP of 1.42, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxyethyl)-3,3-diethyl-1-methylurea is sourced from PubChem (CID 115887200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).