2-(1-ethoxy-2,2-dimethylpropyl)-1,4-dihydroimidazol-5-one

C10H18N2O2 — CID 106951930

IUPAC2-(1-ethoxy-2,2-dimethylpropyl)-1,4-dihydroimidazol-5-one
SMILESCCOC(C1=NCC(=O)N1)C(C)(C)C
InChIInChI=1S/C10H18N2O2/c1-5-14-8(10(2,3)4)9-11-6-7(13)12-9/h8H,5-6H2,1-4H3,(H,11,12,13)
InChIKeyZGMVNPJHKSGZBY-UHFFFAOYSA-N
MW198.27 g/mol
LogP0.97
Rot. Bonds3

About 2-(1-ethoxy-2,2-dimethylpropyl)-1,4-dihydroimidazol-5-one

2-(1-ethoxy-2,2-dimethylpropyl)-1,4-dihydroimidazol-5-one (PubChem CID 106951930) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 2-(1-ethoxy-2,2-dimethylpropyl)-1,4-dihydroimidazol-5-one.

Molecular Properties

Compound Name2-(1-ethoxy-2,2-dimethylpropyl)-1,4-dihydroimidazol-5-one
PubChem CID106951930
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC Name2-(1-ethoxy-2,2-dimethylpropyl)-1,4-dihydroimidazol-5-one
SMILESCCOC(C1=NCC(=O)N1)C(C)(C)C
InChIInChI=1S/C10H18N2O2/c1-5-14-8(10(2,3)4)9-11-6-7(13)12-9/h8H,5-6H2,1-4H3,(H,11,12,13)
InChIKeyZGMVNPJHKSGZBY-UHFFFAOYSA-N
XLogP0.97
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1-ethoxy-2,2-dimethylpropyl)-1,4-dihydroimidazol-5-one?
The IUPAC name of 2-(1-ethoxy-2,2-dimethylpropyl)-1,4-dihydroimidazol-5-one (CID 106951930) is 2-(1-ethoxy-2,2-dimethylpropyl)-1,4-dihydroimidazol-5-one.
What is the SMILES notation for 2-(1-ethoxy-2,2-dimethylpropyl)-1,4-dihydroimidazol-5-one?
The canonical SMILES for 2-(1-ethoxy-2,2-dimethylpropyl)-1,4-dihydroimidazol-5-one is CCOC(C1=NCC(=O)N1)C(C)(C)C.
What is the InChIKey of 2-(1-ethoxy-2,2-dimethylpropyl)-1,4-dihydroimidazol-5-one?
The InChIKey is ZGMVNPJHKSGZBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-5-14-8(10(2,3)4)9-11-6-7(13)12-9/h8H,5-6H2,1-4H3,(H,11,12,13).
What are the key properties of 2-(1-ethoxy-2,2-dimethylpropyl)-1,4-dihydroimidazol-5-one?
2-(1-ethoxy-2,2-dimethylpropyl)-1,4-dihydroimidazol-5-one has a molecular weight of 198.27 g/mol, XLogP of 0.97, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethoxy-2,2-dimethylpropyl)-1,4-dihydroimidazol-5-one is sourced from PubChem (CID 106951930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).