1-[3-(2-hydroxyethoxy)butyl]imidazolidin-2-one

C9H18N2O3 — CID 57297163

IUPAC1-[3-(2-hydroxyethoxy)butyl]imidazolidin-2-one
SMILESCC(CCN1CCNC1=O)OCCO
InChIInChI=1S/C9H18N2O3/c1-8(14-7-6-12)2-4-11-5-3-10-9(11)13/h8,12H,2-7H2,1H3,(H,10,13)
InChIKeyCIIMNINEPSPHBI-UHFFFAOYSA-N
MW202.25 g/mol
LogP-0.20
Rot. Bonds6

About 1-[3-(2-hydroxyethoxy)butyl]imidazolidin-2-one

1-[3-(2-hydroxyethoxy)butyl]imidazolidin-2-one (PubChem CID 57297163) has the molecular formula C9H18N2O3 and a molecular weight of 202.25 g/mol. Its IUPAC name is 1-[3-(2-hydroxyethoxy)butyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[3-(2-hydroxyethoxy)butyl]imidazolidin-2-one
PubChem CID57297163
Molecular FormulaC9H18N2O3
Molecular Weight202.25 g/mol
Exact Mass202.13
IUPAC Name1-[3-(2-hydroxyethoxy)butyl]imidazolidin-2-one
SMILESCC(CCN1CCNC1=O)OCCO
InChIInChI=1S/C9H18N2O3/c1-8(14-7-6-12)2-4-11-5-3-10-9(11)13/h8,12H,2-7H2,1H3,(H,10,13)
InChIKeyCIIMNINEPSPHBI-UHFFFAOYSA-N
XLogP-0.20
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 5-0.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[3-(2-hydroxyethoxy)butyl]imidazolidin-2-one?
The IUPAC name of 1-[3-(2-hydroxyethoxy)butyl]imidazolidin-2-one (CID 57297163) is 1-[3-(2-hydroxyethoxy)butyl]imidazolidin-2-one.
What is the SMILES notation for 1-[3-(2-hydroxyethoxy)butyl]imidazolidin-2-one?
The canonical SMILES for 1-[3-(2-hydroxyethoxy)butyl]imidazolidin-2-one is CC(CCN1CCNC1=O)OCCO.
What is the InChIKey of 1-[3-(2-hydroxyethoxy)butyl]imidazolidin-2-one?
The InChIKey is CIIMNINEPSPHBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O3/c1-8(14-7-6-12)2-4-11-5-3-10-9(11)13/h8,12H,2-7H2,1H3,(H,10,13).
What are the key properties of 1-[3-(2-hydroxyethoxy)butyl]imidazolidin-2-one?
1-[3-(2-hydroxyethoxy)butyl]imidazolidin-2-one has a molecular weight of 202.25 g/mol, XLogP of -0.20, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2-hydroxyethoxy)butyl]imidazolidin-2-one is sourced from PubChem (CID 57297163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).