4-[2-(4-bromophenyl)imidazol-1-yl]piperidine

C14H16BrN3 — CID 82559669

IUPAC4-[2-(4-bromophenyl)imidazol-1-yl]piperidine
SMILESBrc1ccc(-c2nccn2C2CCNCC2)cc1
InChIInChI=1S/C14H16BrN3/c15-12-3-1-11(2-4-12)14-17-9-10-18(14)13-5-7-16-8-6-13/h1-4,9-10,13,16H,5-8H2
InChIKeyKAZNEGUJUUZOOY-UHFFFAOYSA-N
MW306.21 g/mol
LogP3.24
Rot. Bonds2

About 4-[2-(4-bromophenyl)imidazol-1-yl]piperidine

4-[2-(4-bromophenyl)imidazol-1-yl]piperidine (PubChem CID 82559669) has the molecular formula C14H16BrN3 and a molecular weight of 306.21 g/mol. Its IUPAC name is 4-[2-(4-bromophenyl)imidazol-1-yl]piperidine.

Molecular Properties

Compound Name4-[2-(4-bromophenyl)imidazol-1-yl]piperidine
PubChem CID82559669
Molecular FormulaC14H16BrN3
Molecular Weight306.21 g/mol
Exact Mass305.05
IUPAC Name4-[2-(4-bromophenyl)imidazol-1-yl]piperidine
SMILESBrc1ccc(-c2nccn2C2CCNCC2)cc1
InChIInChI=1S/C14H16BrN3/c15-12-3-1-11(2-4-12)14-17-9-10-18(14)13-5-7-16-8-6-13/h1-4,9-10,13,16H,5-8H2
InChIKeyKAZNEGUJUUZOOY-UHFFFAOYSA-N
XLogP3.24
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.21
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-[2-(4-bromophenyl)imidazol-1-yl]piperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[2-(3-bromophenyl)imidazol-1-yl]piperidine
CID 82559766
4-(2-naphthalen-2-ylimidazol-1-yl)piperidine
CID 68729306
4-[2-(2,3,4-trifluorophenyl)imidazol-1-yl]piperidine
CID 82559295
4-(2-methylimidazol-1-yl)piperidine;dihydrochloride
CID 131883405
1-[(3S)-pyrrolidin-3-yl]-2-[4-(2,2,2-trifluoroethyl)phenyl]imidazole;dihydrochloride
CID 154923690
4-[2-[(3-bromophenyl)methyl]imidazol-1-yl]piperidine
CID 82558165
(3S,4S)-4-[2-(3,4-difluorophenyl)imidazol-1-yl]piperidin-3-ol
CID 154821312
2-benzylsulfanyl-5-(1-pyrrolidin-3-ylimidazol-2-yl)pyrimidine
CID 70709377
(3R,4S)-4-[2-(2,6-difluorophenyl)imidazol-1-yl]-3-methylpiperidine
CID 146044197
9-[4-(1-cyclohexylimidazol-2-yl)phenyl]carbazole
CID 140799922
4-[[4-(1-methylimidazol-2-yl)phenyl]methyl]piperidine
CID 117391867
4-[1-(thiolan-3-yl)imidazol-2-yl]pyridine
CID 155910854

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-bromophenyl)imidazol-1-yl]piperidine?
The IUPAC name of 4-[2-(4-bromophenyl)imidazol-1-yl]piperidine (CID 82559669) is 4-[2-(4-bromophenyl)imidazol-1-yl]piperidine.
What is the SMILES notation for 4-[2-(4-bromophenyl)imidazol-1-yl]piperidine?
The canonical SMILES for 4-[2-(4-bromophenyl)imidazol-1-yl]piperidine is Brc1ccc(-c2nccn2C2CCNCC2)cc1.
What is the InChIKey of 4-[2-(4-bromophenyl)imidazol-1-yl]piperidine?
The InChIKey is KAZNEGUJUUZOOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16BrN3/c15-12-3-1-11(2-4-12)14-17-9-10-18(14)13-5-7-16-8-6-13/h1-4,9-10,13,16H,5-8H2.
What are the key properties of 4-[2-(4-bromophenyl)imidazol-1-yl]piperidine?
4-[2-(4-bromophenyl)imidazol-1-yl]piperidine has a molecular weight of 306.21 g/mol, XLogP of 3.24, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-bromophenyl)imidazol-1-yl]piperidine is sourced from PubChem (CID 82559669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).