2-propan-2-yloxyethylurea

C6H14N2O2 — CID 22179539

IUPAC2-propan-2-yloxyethylurea
SMILESCC(C)OCCNC(N)=O
InChIInChI=1S/C6H14N2O2/c1-5(2)10-4-3-8-6(7)9/h5H,3-4H2,1-2H3,(H3,7,8,9)
InChIKeyBEWVZKCMEMXARG-UHFFFAOYSA-N
MW146.19 g/mol
LogP0.08
Rot. Bonds4

About 2-propan-2-yloxyethylurea

2-propan-2-yloxyethylurea (PubChem CID 22179539) has the molecular formula C6H14N2O2 and a molecular weight of 146.19 g/mol. Its IUPAC name is 2-propan-2-yloxyethylurea.

Molecular Properties

Compound Name2-propan-2-yloxyethylurea
PubChem CID22179539
Molecular FormulaC6H14N2O2
Molecular Weight146.19 g/mol
Exact Mass146.11
IUPAC Name2-propan-2-yloxyethylurea
SMILESCC(C)OCCNC(N)=O
InChIInChI=1S/C6H14N2O2/c1-5(2)10-4-3-8-6(7)9/h5H,3-4H2,1-2H3,(H3,7,8,9)
InChIKeyBEWVZKCMEMXARG-UHFFFAOYSA-N
XLogP0.08
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 50.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-propan-2-yloxyethylurea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R)-2-amino-3-methyl-N-(2-propan-2-yloxyethyl)butanamide
CID 104761131
ethyl N-(2-propan-2-yloxyethyl)carbamate
CID 14496147
2-carbamothioyl-N-(2-propan-2-yloxyethyl)butanamide
CID 104761678
1-amino-N-(2-propan-2-yloxyethyl)cyclopropane-1-carboxamide
CID 104761182
2-(N'-hydroxycarbamimidoyl)-3-methyl-N-(2-propan-2-yloxyethyl)butanamide
CID 104764610
2-(1,2,2,2-tetrafluoroethoxy)ethylurea
CID 57024872
2-(aminomethyl)-N-(2-propan-2-yloxyethyl)butanamide
CID 104759858
2-carbamothioyl-N-(2-propan-2-yloxyethyl)pentanamide
CID 104761692
1-carbamothioyl-N-(2-propan-2-yloxyethyl)cyclopropane-1-carboxamide
CID 104761691
3-[2-[2-[1-[2-(carbamoylamino)ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
CID 173187285
2-(aminomethyl)-2-ethyl-N-(2-propan-2-yloxyethyl)butanamide
CID 104759851
2-(propan-2-ylamino)-N-(2-propan-2-yloxyethyl)acetamide
CID 104761099

Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yloxyethylurea?
The IUPAC name of 2-propan-2-yloxyethylurea (CID 22179539) is 2-propan-2-yloxyethylurea.
What is the SMILES notation for 2-propan-2-yloxyethylurea?
The canonical SMILES for 2-propan-2-yloxyethylurea is CC(C)OCCNC(N)=O.
What is the InChIKey of 2-propan-2-yloxyethylurea?
The InChIKey is BEWVZKCMEMXARG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O2/c1-5(2)10-4-3-8-6(7)9/h5H,3-4H2,1-2H3,(H3,7,8,9).
What are the key properties of 2-propan-2-yloxyethylurea?
2-propan-2-yloxyethylurea has a molecular weight of 146.19 g/mol, XLogP of 0.08, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yloxyethylurea is sourced from PubChem (CID 22179539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).