4-(5-bromothiophen-2-yl)-1-(2-hydroxyethyl)imidazolidin-2-one

C9H11BrN2O2S — CID 116979352

IUPAC4-(5-bromothiophen-2-yl)-1-(2-hydroxyethyl)imidazolidin-2-one
SMILESO=C1NC(c2ccc(Br)s2)CN1CCO
InChIInChI=1S/C9H11BrN2O2S/c10-8-2-1-7(15-8)6-5-12(3-4-13)9(14)11-6/h1-2,6,13H,3-5H2,(H,11,14)
InChIKeyKYQGGUWPXQZBIX-UHFFFAOYSA-N
MW291.17 g/mol
LogP1.57
Rot. Bonds3

About 4-(5-bromothiophen-2-yl)-1-(2-hydroxyethyl)imidazolidin-2-one

4-(5-bromothiophen-2-yl)-1-(2-hydroxyethyl)imidazolidin-2-one (PubChem CID 116979352) has the molecular formula C9H11BrN2O2S and a molecular weight of 291.17 g/mol. Its IUPAC name is 4-(5-bromothiophen-2-yl)-1-(2-hydroxyethyl)imidazolidin-2-one.

Molecular Properties

Compound Name4-(5-bromothiophen-2-yl)-1-(2-hydroxyethyl)imidazolidin-2-one
PubChem CID116979352
Molecular FormulaC9H11BrN2O2S
Molecular Weight291.17 g/mol
Exact Mass289.97
IUPAC Name4-(5-bromothiophen-2-yl)-1-(2-hydroxyethyl)imidazolidin-2-one
SMILESO=C1NC(c2ccc(Br)s2)CN1CCO
InChIInChI=1S/C9H11BrN2O2S/c10-8-2-1-7(15-8)6-5-12(3-4-13)9(14)11-6/h1-2,6,13H,3-5H2,(H,11,14)
InChIKeyKYQGGUWPXQZBIX-UHFFFAOYSA-N
XLogP1.57
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.17
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(5-bromothiophen-2-yl)-1-(pyrrolidin-2-ylmethyl)imidazolidin-2-one
CID 116979075
2-[4-(5-bromothiophen-2-yl)-2-oxoimidazolidin-1-yl]cyclopropane-1-carboxylic acid
CID 116979765
(4S)-4-(2,3-dichloro-6-hydroxyphenyl)-1-(2-hydroxyethyl)imidazolidin-2-one
CID 163241217
1-(3-aminobutyl)-4-(4-bromothiophen-2-yl)imidazolidin-2-one
CID 116978759
1-(2-hydroxyethyl)-4-(1-methylindol-3-yl)imidazolidin-2-one
CID 116979364
2-[4-(5-bromothiophen-2-yl)-3-methyl-2-oxoimidazolidin-1-yl]acetic acid
CID 116982015
4-(5-bromothiophen-2-yl)-3-methyl-1-(2-sulfanylethyl)imidazolidin-2-one
CID 116982246
4-(5-bromothiophen-2-yl)-3-methyl-1-(3-oxobutyl)imidazolidin-2-one
CID 116982714
1-(2-aminoethyl)-4-(5-bromothiophen-2-yl)-3-methylimidazolidin-2-one
CID 116981193
methyl 3-(2-oxo-4-thiophen-2-ylimidazolidin-1-yl)propanoate
CID 116980356
(2R)-2-(5-bromothiophen-2-yl)piperidine
CID 7048175
3-[4-(2-bromophenyl)-2-oxoimidazolidin-1-yl]propanoic acid
CID 116979536

Frequently Asked Questions

What is the IUPAC name of 4-(5-bromothiophen-2-yl)-1-(2-hydroxyethyl)imidazolidin-2-one?
The IUPAC name of 4-(5-bromothiophen-2-yl)-1-(2-hydroxyethyl)imidazolidin-2-one (CID 116979352) is 4-(5-bromothiophen-2-yl)-1-(2-hydroxyethyl)imidazolidin-2-one.
What is the SMILES notation for 4-(5-bromothiophen-2-yl)-1-(2-hydroxyethyl)imidazolidin-2-one?
The canonical SMILES for 4-(5-bromothiophen-2-yl)-1-(2-hydroxyethyl)imidazolidin-2-one is O=C1NC(c2ccc(Br)s2)CN1CCO.
What is the InChIKey of 4-(5-bromothiophen-2-yl)-1-(2-hydroxyethyl)imidazolidin-2-one?
The InChIKey is KYQGGUWPXQZBIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11BrN2O2S/c10-8-2-1-7(15-8)6-5-12(3-4-13)9(14)11-6/h1-2,6,13H,3-5H2,(H,11,14).
What are the key properties of 4-(5-bromothiophen-2-yl)-1-(2-hydroxyethyl)imidazolidin-2-one?
4-(5-bromothiophen-2-yl)-1-(2-hydroxyethyl)imidazolidin-2-one has a molecular weight of 291.17 g/mol, XLogP of 1.57, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-bromothiophen-2-yl)-1-(2-hydroxyethyl)imidazolidin-2-one is sourced from PubChem (CID 116979352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).