2-[2-[(4-bromophenyl)methoxy]phenyl]-4,5-dihydro-1H-imidazole

C16H15BrN2O — CID 82240374

IUPAC2-[2-[(4-bromophenyl)methoxy]phenyl]-4,5-dihydro-1H-imidazole
SMILESBrc1ccc(COc2ccccc2C2=NCCN2)cc1
InChIInChI=1S/C16H15BrN2O/c17-13-7-5-12(6-8-13)11-20-15-4-2-1-3-14(15)16-18-9-10-19-16/h1-8H,9-11H2,(H,18,19)
InChIKeyAQMZGJKEHKAEIE-UHFFFAOYSA-N
MW331.21 g/mol
LogP3.38
Rot. Bonds4

About 2-[2-[(4-bromophenyl)methoxy]phenyl]-4,5-dihydro-1H-imidazole

2-[2-[(4-bromophenyl)methoxy]phenyl]-4,5-dihydro-1H-imidazole (PubChem CID 82240374) has the molecular formula C16H15BrN2O and a molecular weight of 331.21 g/mol. Its IUPAC name is 2-[2-[(4-bromophenyl)methoxy]phenyl]-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name2-[2-[(4-bromophenyl)methoxy]phenyl]-4,5-dihydro-1H-imidazole
PubChem CID82240374
Molecular FormulaC16H15BrN2O
Molecular Weight331.21 g/mol
Exact Mass330.04
IUPAC Name2-[2-[(4-bromophenyl)methoxy]phenyl]-4,5-dihydro-1H-imidazole
SMILESBrc1ccc(COc2ccccc2C2=NCCN2)cc1
InChIInChI=1S/C16H15BrN2O/c17-13-7-5-12(6-8-13)11-20-15-4-2-1-3-14(15)16-18-9-10-19-16/h1-8H,9-11H2,(H,18,19)
InChIKeyAQMZGJKEHKAEIE-UHFFFAOYSA-N
XLogP3.38
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.21
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[2-[(4-bromophenyl)methoxy]phenyl]-4,5-dihydro-1H-imidazole 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

2-[2-[(4-bromophenyl)methoxy]phenyl]-1,4,5,6-tetrahydropyrimidine
CID 82252851
2-[4-[(4-bromophenoxy)methyl]phenyl]-4,5-dihydro-1H-imidazole
CID 82240381
2-(2-butoxyphenyl)-4,5-dihydro-1H-imidazole;hydrobromide
CID 131884841
2-[2-(3-phenoxypropoxy)phenyl]-4,5-dihydro-1H-imidazole
CID 82251671
2-[2-(methoxymethyl)phenyl]-4,5-dihydro-1H-imidazole
CID 82241061
2-[2-(4,5-dihydro-1H-imidazol-2-yl)phenoxy]propanoic acid
CID 82243185
1-bromo-4-[[2-(bromomethyl)phenoxy]methyl]benzene
CID 43141593
2-(3,5-dimethoxy-4-phenylmethoxyphenyl)-4,5-dihydro-1H-imidazole
CID 110537997
2-[2-(2,3,6-trimethylphenoxy)phenyl]-4,5-dihydro-1H-imidazole
CID 82249041
4-[[4-(4,5-dihydro-1H-imidazol-2-yl)-2-fluorophenoxy]methyl]-N,N-dimethylaniline
CID 82252766
2-[3-[(3-bromophenoxy)methyl]phenyl]-4,5-dihydro-1H-imidazole
CID 82240383
2-[2-(pyridin-4-ylmethoxy)-3-pyridinyl]-1,4,5,6-tetrahydropyrimidine
CID 82247194

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(4-bromophenyl)methoxy]phenyl]-4,5-dihydro-1H-imidazole?
The IUPAC name of 2-[2-[(4-bromophenyl)methoxy]phenyl]-4,5-dihydro-1H-imidazole (CID 82240374) is 2-[2-[(4-bromophenyl)methoxy]phenyl]-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 2-[2-[(4-bromophenyl)methoxy]phenyl]-4,5-dihydro-1H-imidazole?
The canonical SMILES for 2-[2-[(4-bromophenyl)methoxy]phenyl]-4,5-dihydro-1H-imidazole is Brc1ccc(COc2ccccc2C2=NCCN2)cc1.
What is the InChIKey of 2-[2-[(4-bromophenyl)methoxy]phenyl]-4,5-dihydro-1H-imidazole?
The InChIKey is AQMZGJKEHKAEIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15BrN2O/c17-13-7-5-12(6-8-13)11-20-15-4-2-1-3-14(15)16-18-9-10-19-16/h1-8H,9-11H2,(H,18,19).
What are the key properties of 2-[2-[(4-bromophenyl)methoxy]phenyl]-4,5-dihydro-1H-imidazole?
2-[2-[(4-bromophenyl)methoxy]phenyl]-4,5-dihydro-1H-imidazole has a molecular weight of 331.21 g/mol, XLogP of 3.38, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(4-bromophenyl)methoxy]phenyl]-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 82240374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).