1-(3-bromoquinolin-8-yl)imidazolidin-2-one

C12H10BrN3O — CID 116784875

IUPAC1-(3-bromoquinolin-8-yl)imidazolidin-2-one
SMILESO=C1NCCN1c1cccc2cc(Br)cnc12
InChIInChI=1S/C12H10BrN3O/c13-9-6-8-2-1-3-10(11(8)15-7-9)16-5-4-14-12(16)17/h1-3,6-7H,4-5H2,(H,14,17)
InChIKeyKUWGBAADFOOXAJ-UHFFFAOYSA-N
MW292.14 g/mol
LogP2.53
Rot. Bonds1

About 1-(3-bromoquinolin-8-yl)imidazolidin-2-one

1-(3-bromoquinolin-8-yl)imidazolidin-2-one (PubChem CID 116784875) has the molecular formula C12H10BrN3O and a molecular weight of 292.14 g/mol. Its IUPAC name is 1-(3-bromoquinolin-8-yl)imidazolidin-2-one.

Molecular Properties

Compound Name1-(3-bromoquinolin-8-yl)imidazolidin-2-one
PubChem CID116784875
Molecular FormulaC12H10BrN3O
Molecular Weight292.14 g/mol
Exact Mass291.00
IUPAC Name1-(3-bromoquinolin-8-yl)imidazolidin-2-one
SMILESO=C1NCCN1c1cccc2cc(Br)cnc12
InChIInChI=1S/C12H10BrN3O/c13-9-6-8-2-1-3-10(11(8)15-7-9)16-5-4-14-12(16)17/h1-3,6-7H,4-5H2,(H,14,17)
InChIKeyKUWGBAADFOOXAJ-UHFFFAOYSA-N
XLogP2.53
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.14
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3-bromoquinolin-8-yl)imidazolidine-2,4-dione
CID 107841893
3-amino-1-(3-bromoquinolin-8-yl)piperidin-2-one
CID 116785604
1-(3-bromoquinolin-8-yl)-3-methyl-1,4-diazepane-2,5-dione
CID 116785723
1-naphthalen-1-ylimidazolidin-2-one
CID 70078556
3-(3-bromoquinolin-8-yl)triazole-4-carboxylic acid
CID 116785401
1-(3-bromoquinolin-8-yl)-N-cyclopropylpyrrolidin-3-amine
CID 116785617
3-bromo-8-[4-(bromomethyl)triazol-1-yl]quinoline
CID 116785501
1-(3-bromoquinolin-8-yl)-2-methylpiperidin-4-amine
CID 116784942
3-bromo-8-(2-ethyl-5-methylpiperazin-1-yl)quinoline
CID 116785676
2-[1-(3-bromoquinolin-8-yl)triazol-4-yl]ethanamine
CID 116785445
3-bromo-1,10-phenanthroline;ruthenium
CID 59061228
3-bromo-8-chloroquinoline;tetramethylazanium
CID 67706558

Frequently Asked Questions

What is the IUPAC name of 1-(3-bromoquinolin-8-yl)imidazolidin-2-one?
The IUPAC name of 1-(3-bromoquinolin-8-yl)imidazolidin-2-one (CID 116784875) is 1-(3-bromoquinolin-8-yl)imidazolidin-2-one.
What is the SMILES notation for 1-(3-bromoquinolin-8-yl)imidazolidin-2-one?
The canonical SMILES for 1-(3-bromoquinolin-8-yl)imidazolidin-2-one is O=C1NCCN1c1cccc2cc(Br)cnc12.
What is the InChIKey of 1-(3-bromoquinolin-8-yl)imidazolidin-2-one?
The InChIKey is KUWGBAADFOOXAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrN3O/c13-9-6-8-2-1-3-10(11(8)15-7-9)16-5-4-14-12(16)17/h1-3,6-7H,4-5H2,(H,14,17).
What are the key properties of 1-(3-bromoquinolin-8-yl)imidazolidin-2-one?
1-(3-bromoquinolin-8-yl)imidazolidin-2-one has a molecular weight of 292.14 g/mol, XLogP of 2.53, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-bromoquinolin-8-yl)imidazolidin-2-one is sourced from PubChem (CID 116784875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).