2-(3-bromophenyl)imidazolidine

C9H11BrN2 — CID 57237390

IUPAC2-(3-bromophenyl)imidazolidine
SMILESBrc1cccc(C2NCCN2)c1
InChIInChI=1S/C9H11BrN2/c10-8-3-1-2-7(6-8)9-11-4-5-12-9/h1-3,6,9,11-12H,4-5H2
InChIKeyVMJXFBATTMYJHA-UHFFFAOYSA-N
MW227.10 g/mol
LogP1.64
Rot. Bonds1

About 2-(3-bromophenyl)imidazolidine

2-(3-bromophenyl)imidazolidine (PubChem CID 57237390) has the molecular formula C9H11BrN2 and a molecular weight of 227.10 g/mol. Its IUPAC name is 2-(3-bromophenyl)imidazolidine.

Molecular Properties

Compound Name2-(3-bromophenyl)imidazolidine
PubChem CID57237390
Molecular FormulaC9H11BrN2
Molecular Weight227.10 g/mol
Exact Mass226.01
IUPAC Name2-(3-bromophenyl)imidazolidine
SMILESBrc1cccc(C2NCCN2)c1
InChIInChI=1S/C9H11BrN2/c10-8-3-1-2-7(6-8)9-11-4-5-12-9/h1-3,6,9,11-12H,4-5H2
InChIKeyVMJXFBATTMYJHA-UHFFFAOYSA-N
XLogP1.64
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.10
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-bromophenyl)pyrrolidin-3-one
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2-(3-bromophenyl)-3-methylmorpholine
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2-(3-bromophenyl)-4-fluoropyrrolidine
CID 84728358
(2S)-2-(3-bromophenyl)morpholine
CID 28806253
2-(3-bromophenyl)-4-methylazetidine
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1-bromo-3-[(1R)-2,2-difluorocyclopropyl]benzene
CID 97296884
4-(3-bromophenyl)-3,3-difluoropiperidine
CID 105426890
2-(3-bromophenyl)-3,4-dihydro-2H-1,3-oxazine
CID 151679409
2-(3-bromophenyl)-4,4-difluoropyrrolidine
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3-(3-bromophenyl)-4,4-diethylpiperidine
CID 79433788

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromophenyl)imidazolidine?
The IUPAC name of 2-(3-bromophenyl)imidazolidine (CID 57237390) is 2-(3-bromophenyl)imidazolidine.
What is the SMILES notation for 2-(3-bromophenyl)imidazolidine?
The canonical SMILES for 2-(3-bromophenyl)imidazolidine is Brc1cccc(C2NCCN2)c1.
What is the InChIKey of 2-(3-bromophenyl)imidazolidine?
The InChIKey is VMJXFBATTMYJHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11BrN2/c10-8-3-1-2-7(6-8)9-11-4-5-12-9/h1-3,6,9,11-12H,4-5H2.
What are the key properties of 2-(3-bromophenyl)imidazolidine?
2-(3-bromophenyl)imidazolidine has a molecular weight of 227.10 g/mol, XLogP of 1.64, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromophenyl)imidazolidine is sourced from PubChem (CID 57237390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).