1-(dipropoxymethyl)imidazolidin-2-one

C10H20N2O3 — CID 90746582

IUPAC1-(dipropoxymethyl)imidazolidin-2-one
SMILESCCCOC(OCCC)N1CCNC1=O
InChIInChI=1S/C10H20N2O3/c1-3-7-14-10(15-8-4-2)12-6-5-11-9(12)13/h10H,3-8H2,1-2H3,(H,11,13)
InChIKeyAWYRLJJMGAHROL-UHFFFAOYSA-N
MW216.28 g/mol
LogP1.15
Rot. Bonds7

About 1-(dipropoxymethyl)imidazolidin-2-one

1-(dipropoxymethyl)imidazolidin-2-one (PubChem CID 90746582) has the molecular formula C10H20N2O3 and a molecular weight of 216.28 g/mol. Its IUPAC name is 1-(dipropoxymethyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-(dipropoxymethyl)imidazolidin-2-one
PubChem CID90746582
Molecular FormulaC10H20N2O3
Molecular Weight216.28 g/mol
Exact Mass216.15
IUPAC Name1-(dipropoxymethyl)imidazolidin-2-one
SMILESCCCOC(OCCC)N1CCNC1=O
InChIInChI=1S/C10H20N2O3/c1-3-7-14-10(15-8-4-2)12-6-5-11-9(12)13/h10H,3-8H2,1-2H3,(H,11,13)
InChIKeyAWYRLJJMGAHROL-UHFFFAOYSA-N
XLogP1.15
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(dipropoxymethyl)imidazolidin-2-one?
The IUPAC name of 1-(dipropoxymethyl)imidazolidin-2-one (CID 90746582) is 1-(dipropoxymethyl)imidazolidin-2-one.
What is the SMILES notation for 1-(dipropoxymethyl)imidazolidin-2-one?
The canonical SMILES for 1-(dipropoxymethyl)imidazolidin-2-one is CCCOC(OCCC)N1CCNC1=O.
What is the InChIKey of 1-(dipropoxymethyl)imidazolidin-2-one?
The InChIKey is AWYRLJJMGAHROL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3/c1-3-7-14-10(15-8-4-2)12-6-5-11-9(12)13/h10H,3-8H2,1-2H3,(H,11,13).
What are the key properties of 1-(dipropoxymethyl)imidazolidin-2-one?
1-(dipropoxymethyl)imidazolidin-2-one has a molecular weight of 216.28 g/mol, XLogP of 1.15, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dipropoxymethyl)imidazolidin-2-one is sourced from PubChem (CID 90746582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).