3-(2-methoxypropyl)-2-propan-2-ylimidazolidin-4-one

C10H20N2O2 — CID 102702006

IUPAC3-(2-methoxypropyl)-2-propan-2-ylimidazolidin-4-one
SMILESCOC(C)CN1C(=O)CNC1C(C)C
InChIInChI=1S/C10H20N2O2/c1-7(2)10-11-5-9(13)12(10)6-8(3)14-4/h7-8,10-11H,5-6H2,1-4H3
InChIKeyFBIAHTOXQWRZKZ-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.44
Rot. Bonds4

About 3-(2-methoxypropyl)-2-propan-2-ylimidazolidin-4-one

3-(2-methoxypropyl)-2-propan-2-ylimidazolidin-4-one (PubChem CID 102702006) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 3-(2-methoxypropyl)-2-propan-2-ylimidazolidin-4-one.

Molecular Properties

Compound Name3-(2-methoxypropyl)-2-propan-2-ylimidazolidin-4-one
PubChem CID102702006
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name3-(2-methoxypropyl)-2-propan-2-ylimidazolidin-4-one
SMILESCOC(C)CN1C(=O)CNC1C(C)C
InChIInChI=1S/C10H20N2O2/c1-7(2)10-11-5-9(13)12(10)6-8(3)14-4/h7-8,10-11H,5-6H2,1-4H3
InChIKeyFBIAHTOXQWRZKZ-UHFFFAOYSA-N
XLogP0.44
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxypropyl)-2-propan-2-ylimidazolidin-4-one?
The IUPAC name of 3-(2-methoxypropyl)-2-propan-2-ylimidazolidin-4-one (CID 102702006) is 3-(2-methoxypropyl)-2-propan-2-ylimidazolidin-4-one.
What is the SMILES notation for 3-(2-methoxypropyl)-2-propan-2-ylimidazolidin-4-one?
The canonical SMILES for 3-(2-methoxypropyl)-2-propan-2-ylimidazolidin-4-one is COC(C)CN1C(=O)CNC1C(C)C.
What is the InChIKey of 3-(2-methoxypropyl)-2-propan-2-ylimidazolidin-4-one?
The InChIKey is FBIAHTOXQWRZKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-7(2)10-11-5-9(13)12(10)6-8(3)14-4/h7-8,10-11H,5-6H2,1-4H3.
What are the key properties of 3-(2-methoxypropyl)-2-propan-2-ylimidazolidin-4-one?
3-(2-methoxypropyl)-2-propan-2-ylimidazolidin-4-one has a molecular weight of 200.28 g/mol, XLogP of 0.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxypropyl)-2-propan-2-ylimidazolidin-4-one is sourced from PubChem (CID 102702006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).