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

C11H11N3O2 — CID 79960453

IUPAC4-amino-5-(2,3-dihydro-1-benzofuran-5-yl)-1,5-dihydroimidazol-2-one
SMILESNC1=NC(=O)NC1c1ccc2c(c1)CCO2
InChIInChI=1S/C11H11N3O2/c12-10-9(13-11(15)14-10)7-1-2-8-6(5-7)3-4-16-8/h1-2,5,9H,3-4H2,(H3,12,13,14,15)
InChIKeyGEHXNJVRGXWSOC-UHFFFAOYSA-N
MW217.23 g/mol
LogP0.74
Rot. Bonds1

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

4-amino-5-(2,3-dihydro-1-benzofuran-5-yl)-1,5-dihydroimidazol-2-one (PubChem CID 79960453) has the molecular formula C11H11N3O2 and a molecular weight of 217.23 g/mol. Its IUPAC name is 4-amino-5-(2,3-dihydro-1-benzofuran-5-yl)-1,5-dihydroimidazol-2-one.

Molecular Properties

Compound Name4-amino-5-(2,3-dihydro-1-benzofuran-5-yl)-1,5-dihydroimidazol-2-one
PubChem CID79960453
Molecular FormulaC11H11N3O2
Molecular Weight217.23 g/mol
Exact Mass217.09
IUPAC Name4-amino-5-(2,3-dihydro-1-benzofuran-5-yl)-1,5-dihydroimidazol-2-one
SMILESNC1=NC(=O)NC1c1ccc2c(c1)CCO2
InChIInChI=1S/C11H11N3O2/c12-10-9(13-11(15)14-10)7-1-2-8-6(5-7)3-4-16-8/h1-2,5,9H,3-4H2,(H3,12,13,14,15)
InChIKeyGEHXNJVRGXWSOC-UHFFFAOYSA-N
XLogP0.74
TPSA76.71 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.23
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-5-(1,3-benzodioxol-5-yl)-1,5-dihydroimidazol-2-one
CID 79962095
(2S)-2-(2,3-dihydro-1-benzofuran-5-yl)azetidine;hydrochloride
CID 171196730
(3R,4R)-4-(2,3-dihydro-1-benzofuran-5-yl)pyrrolidin-3-amine
CID 129493232
4-amino-5-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-1,5-dihydroimidazol-2-one
CID 79960436
2-(2,3-dihydro-1-benzofuran-5-yl)cyclopropan-1-amine
CID 43810363
5-cyclohexyl-2,3-dihydro-1-benzofuran
CID 150562442
6-(2,3-dihydro-1-benzofuran-5-yl)piperidine-3-sulfonamide
CID 104544340
4-(2,3-dihydro-1-benzofuran-5-yl)-1-ethylimidazolidin-2-one
CID 116981042
5-(2,3-dihydro-1-benzofuran-5-yl)pyrazolidin-3-amine
CID 76936947
(2S)-2-(2,3-dihydro-1-benzofuran-5-yl)piperidine
CID 96763073
1-(2-aminopropyl)-4-(2,3-dihydro-1-benzofuran-5-yl)imidazolidin-2-one
CID 116978412
2-(2,3-dihydro-1-benzofuran-5-yl)cyclopropane-1-carboxylic acid
CID 43810297

Frequently Asked Questions

What is the IUPAC name of 4-amino-5-(2,3-dihydro-1-benzofuran-5-yl)-1,5-dihydroimidazol-2-one?
The IUPAC name of 4-amino-5-(2,3-dihydro-1-benzofuran-5-yl)-1,5-dihydroimidazol-2-one (CID 79960453) is 4-amino-5-(2,3-dihydro-1-benzofuran-5-yl)-1,5-dihydroimidazol-2-one.
What is the SMILES notation for 4-amino-5-(2,3-dihydro-1-benzofuran-5-yl)-1,5-dihydroimidazol-2-one?
The canonical SMILES for 4-amino-5-(2,3-dihydro-1-benzofuran-5-yl)-1,5-dihydroimidazol-2-one is NC1=NC(=O)NC1c1ccc2c(c1)CCO2.
What is the InChIKey of 4-amino-5-(2,3-dihydro-1-benzofuran-5-yl)-1,5-dihydroimidazol-2-one?
The InChIKey is GEHXNJVRGXWSOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O2/c12-10-9(13-11(15)14-10)7-1-2-8-6(5-7)3-4-16-8/h1-2,5,9H,3-4H2,(H3,12,13,14,15).
What are the key properties of 4-amino-5-(2,3-dihydro-1-benzofuran-5-yl)-1,5-dihydroimidazol-2-one?
4-amino-5-(2,3-dihydro-1-benzofuran-5-yl)-1,5-dihydroimidazol-2-one has a molecular weight of 217.23 g/mol, XLogP of 0.74, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-(2,3-dihydro-1-benzofuran-5-yl)-1,5-dihydroimidazol-2-one is sourced from PubChem (CID 79960453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).