2-[2-[2-(2-bromo-5-methylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole

C18H19BrN2 — CID 143153209

IUPAC2-[2-[2-(2-bromo-5-methylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole
SMILESCc1ccc(Br)c(CCc2ccccc2C2=NCCN2)c1
InChIInChI=1S/C18H19BrN2/c1-13-6-9-17(19)15(12-13)8-7-14-4-2-3-5-16(14)18-20-10-11-21-18/h2-6,9,12H,7-8,10-11H2,1H3,(H,20,21)
InChIKeyNXXVJKUVEBBTSM-UHFFFAOYSA-N
MW343.27 g/mol
LogP3.89
Rot. Bonds4

About 2-[2-[2-(2-bromo-5-methylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole

2-[2-[2-(2-bromo-5-methylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole (PubChem CID 143153209) has the molecular formula C18H19BrN2 and a molecular weight of 343.27 g/mol. Its IUPAC name is 2-[2-[2-(2-bromo-5-methylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name2-[2-[2-(2-bromo-5-methylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole
PubChem CID143153209
Molecular FormulaC18H19BrN2
Molecular Weight343.27 g/mol
Exact Mass342.07
IUPAC Name2-[2-[2-(2-bromo-5-methylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole
SMILESCc1ccc(Br)c(CCc2ccccc2C2=NCCN2)c1
InChIInChI=1S/C18H19BrN2/c1-13-6-9-17(19)15(12-13)8-7-14-4-2-3-5-16(14)18-20-10-11-21-18/h2-6,9,12H,7-8,10-11H2,1H3,(H,20,21)
InChIKeyNXXVJKUVEBBTSM-UHFFFAOYSA-N
XLogP3.89
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.27
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-(2-phenylethyl)phenyl]-4,5-dihydro-1H-imidazole
CID 11311265
2-[2-[(2-bromophenyl)methoxymethyl]phenyl]-4,5-dihydro-1H-imidazole
CID 82252865
2-[2-[2-(5-chloro-2-fluorophenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole
CID 59715415
1-[2-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-N,N-dimethylmethanamine
CID 82241351
2-[2-[2-(4-methoxyphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole
CID 11265984
2-[2-[2-(2,5-dimethoxyphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole
CID 11536881
2-[2-(methoxymethyl)phenyl]-4,5-dihydro-1H-imidazole
CID 82241061
2-[2-[2-(2-ethyl-5-methylphenyl)ethyl]-3-methylphenyl]-1,4,5,6-tetrahydropyrimidine
CID 142160804
2-(2-fluoro-5-methylphenyl)-4,5-dihydro-1H-imidazole;hydrochloride
CID 171378845
2-[2-(2-(111C)methylphenyl)ethyl]-4,5-dihydro-1H-imidazole
CID 56935582
2-[2-[1-(2-methoxy-5-methylphenyl)propan-2-yl]phenyl]-1,4,5,6-tetrahydropyrimidine;molecular hydrogen
CID 142160816
2-[2-[2-(5-bromo-2-methoxyphenyl)ethyl]-3-fluorophenyl]-4,5-dihydro-1H-imidazole;hydrochloride
CID 90488979

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-(2-bromo-5-methylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole?
The IUPAC name of 2-[2-[2-(2-bromo-5-methylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole (CID 143153209) is 2-[2-[2-(2-bromo-5-methylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 2-[2-[2-(2-bromo-5-methylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole?
The canonical SMILES for 2-[2-[2-(2-bromo-5-methylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole is Cc1ccc(Br)c(CCc2ccccc2C2=NCCN2)c1.
What is the InChIKey of 2-[2-[2-(2-bromo-5-methylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole?
The InChIKey is NXXVJKUVEBBTSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19BrN2/c1-13-6-9-17(19)15(12-13)8-7-14-4-2-3-5-16(14)18-20-10-11-21-18/h2-6,9,12H,7-8,10-11H2,1H3,(H,20,21).
What are the key properties of 2-[2-[2-(2-bromo-5-methylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole?
2-[2-[2-(2-bromo-5-methylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole has a molecular weight of 343.27 g/mol, XLogP of 3.89, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(2-bromo-5-methylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 143153209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).