4-(2,3-dihydro-1-benzofuran-5-yl)-1-ethylimidazolidin-2-one

C13H16N2O2 — CID 116981042

IUPAC4-(2,3-dihydro-1-benzofuran-5-yl)-1-ethylimidazolidin-2-one
SMILESCCN1CC(c2ccc3c(c2)CCO3)NC1=O
InChIInChI=1S/C13H16N2O2/c1-2-15-8-11(14-13(15)16)9-3-4-12-10(7-9)5-6-17-12/h3-4,7,11H,2,5-6,8H2,1H3,(H,14,16)
InChIKeyJYMLBTKHGOIGQN-UHFFFAOYSA-N
MW232.28 g/mol
LogP1.71
Rot. Bonds2

About 4-(2,3-dihydro-1-benzofuran-5-yl)-1-ethylimidazolidin-2-one

4-(2,3-dihydro-1-benzofuran-5-yl)-1-ethylimidazolidin-2-one (PubChem CID 116981042) has the molecular formula C13H16N2O2 and a molecular weight of 232.28 g/mol. Its IUPAC name is 4-(2,3-dihydro-1-benzofuran-5-yl)-1-ethylimidazolidin-2-one.

Molecular Properties

Compound Name4-(2,3-dihydro-1-benzofuran-5-yl)-1-ethylimidazolidin-2-one
PubChem CID116981042
Molecular FormulaC13H16N2O2
Molecular Weight232.28 g/mol
Exact Mass232.12
IUPAC Name4-(2,3-dihydro-1-benzofuran-5-yl)-1-ethylimidazolidin-2-one
SMILESCCN1CC(c2ccc3c(c2)CCO3)NC1=O
InChIInChI=1S/C13H16N2O2/c1-2-15-8-11(14-13(15)16)9-3-4-12-10(7-9)5-6-17-12/h3-4,7,11H,2,5-6,8H2,1H3,(H,14,16)
InChIKeyJYMLBTKHGOIGQN-UHFFFAOYSA-N
XLogP1.71
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-aminopropyl)-4-(2,3-dihydro-1-benzofuran-5-yl)imidazolidin-2-one
CID 116978412
4-(2,3-dihydro-1-benzofuran-5-yl)-1-[2-(methylamino)ethyl]imidazolidin-2-one
CID 116978273
4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-ethylimidazolidin-2-one
CID 116980972
1-ethyl-4-(6-methylnaphthalen-2-yl)imidazolidin-2-one
CID 116981065
(2S)-2-(2,3-dihydro-1-benzofuran-5-yl)azetidine;hydrochloride
CID 171196730
(2S)-2-(2,3-dihydro-1-benzofuran-5-yl)piperidine
CID 96763073
1-ethyl-4-(4-methylsulfonylphenyl)imidazolidin-2-one
CID 116981024
2-(2,3-dihydro-1-benzofuran-5-yl)-4-propylcyclohexane-1-carboxylic acid
CID 104545126
4-amino-5-(2,3-dihydro-1-benzofuran-5-yl)-1,5-dihydroimidazol-2-one
CID 79960453
(3S)-3-(2,3-dihydro-1-benzofuran-5-yl)morpholine
CID 96765724
5-(2,3-dihydro-1-benzofuran-5-yl)pyrazolidin-3-amine
CID 76936947
(3R,4R)-4-(2,3-dihydro-1-benzofuran-5-yl)pyrrolidin-3-amine
CID 129493232

Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dihydro-1-benzofuran-5-yl)-1-ethylimidazolidin-2-one?
The IUPAC name of 4-(2,3-dihydro-1-benzofuran-5-yl)-1-ethylimidazolidin-2-one (CID 116981042) is 4-(2,3-dihydro-1-benzofuran-5-yl)-1-ethylimidazolidin-2-one.
What is the SMILES notation for 4-(2,3-dihydro-1-benzofuran-5-yl)-1-ethylimidazolidin-2-one?
The canonical SMILES for 4-(2,3-dihydro-1-benzofuran-5-yl)-1-ethylimidazolidin-2-one is CCN1CC(c2ccc3c(c2)CCO3)NC1=O.
What is the InChIKey of 4-(2,3-dihydro-1-benzofuran-5-yl)-1-ethylimidazolidin-2-one?
The InChIKey is JYMLBTKHGOIGQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2/c1-2-15-8-11(14-13(15)16)9-3-4-12-10(7-9)5-6-17-12/h3-4,7,11H,2,5-6,8H2,1H3,(H,14,16).
What are the key properties of 4-(2,3-dihydro-1-benzofuran-5-yl)-1-ethylimidazolidin-2-one?
4-(2,3-dihydro-1-benzofuran-5-yl)-1-ethylimidazolidin-2-one has a molecular weight of 232.28 g/mol, XLogP of 1.71, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dihydro-1-benzofuran-5-yl)-1-ethylimidazolidin-2-one is sourced from PubChem (CID 116981042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).