2-(3-bromophenyl)-1-[2-[(2-methylpropan-2-yl)oxy]phenyl]imidazole

C19H19BrN2O — CID 58947187

IUPAC2-(3-bromophenyl)-1-[2-[(2-methylpropan-2-yl)oxy]phenyl]imidazole
SMILESCC(C)(C)Oc1ccccc1-n1ccnc1-c1cccc(Br)c1
InChIInChI=1S/C19H19BrN2O/c1-19(2,3)23-17-10-5-4-9-16(17)22-12-11-21-18(22)14-7-6-8-15(20)13-14/h4-13H,1-3H3
InChIKeyWOCIPXWYMSUJEB-UHFFFAOYSA-N
MW371.28 g/mol
LogP5.48
Rot. Bonds3

About 2-(3-bromophenyl)-1-[2-[(2-methylpropan-2-yl)oxy]phenyl]imidazole

2-(3-bromophenyl)-1-[2-[(2-methylpropan-2-yl)oxy]phenyl]imidazole (PubChem CID 58947187) has the molecular formula C19H19BrN2O and a molecular weight of 371.28 g/mol. Its IUPAC name is 2-(3-bromophenyl)-1-[2-[(2-methylpropan-2-yl)oxy]phenyl]imidazole.

Molecular Properties

Compound Name2-(3-bromophenyl)-1-[2-[(2-methylpropan-2-yl)oxy]phenyl]imidazole
PubChem CID58947187
Molecular FormulaC19H19BrN2O
Molecular Weight371.28 g/mol
Exact Mass370.07
IUPAC Name2-(3-bromophenyl)-1-[2-[(2-methylpropan-2-yl)oxy]phenyl]imidazole
SMILESCC(C)(C)Oc1ccccc1-n1ccnc1-c1cccc(Br)c1
InChIInChI=1S/C19H19BrN2O/c1-19(2,3)23-17-10-5-4-9-16(17)22-12-11-21-18(22)14-7-6-8-15(20)13-14/h4-13H,1-3H3
InChIKeyWOCIPXWYMSUJEB-UHFFFAOYSA-N
XLogP5.48
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500371.28
LogP ≤ 55.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-bromophenyl)-1-phenylimidazole
CID 70654369
1-(benzenesulfonyl)-2-(3-bromophenyl)imidazole
CID 110534917
1-phenyl-2-[3-(1-phenylimidazol-2-yl)phenyl]imidazole
CID 58965505
2-bromo-3-[(2-methylpropan-2-yl)oxy]pyridine
CID 10585519
2-(3-bromophenyl)-1-[2,6-di(propan-2-yl)cyclohexa-1,3,5-trien-1-yl]imidazole
CID 123244310
1-phenyl-2-(3-phenylphenyl)imidazole
CID 157490154
4-[2-(3-bromophenyl)imidazol-1-yl]piperidine
CID 82559766
5-(3-bromophenyl)-2,4-bis[(2-methylpropan-2-yl)oxy]pyrimidine
CID 10452296
methyl 2-[[2-(3-bromophenyl)imidazol-1-yl]methyl]benzoate
CID 82561345
3-(3-bromophenyl)-8-methoxy-[1,2,4]triazolo[4,3-a]pyridine
CID 117145584
1-(2,6-ditert-butyl-4-methylphenyl)-2-phenylimidazole
CID 140703322
2-(2,6-dimethoxyphenyl)-1-(5-fluoro-2-methylphenyl)imidazole
CID 56745803

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromophenyl)-1-[2-[(2-methylpropan-2-yl)oxy]phenyl]imidazole?
The IUPAC name of 2-(3-bromophenyl)-1-[2-[(2-methylpropan-2-yl)oxy]phenyl]imidazole (CID 58947187) is 2-(3-bromophenyl)-1-[2-[(2-methylpropan-2-yl)oxy]phenyl]imidazole.
What is the SMILES notation for 2-(3-bromophenyl)-1-[2-[(2-methylpropan-2-yl)oxy]phenyl]imidazole?
The canonical SMILES for 2-(3-bromophenyl)-1-[2-[(2-methylpropan-2-yl)oxy]phenyl]imidazole is CC(C)(C)Oc1ccccc1-n1ccnc1-c1cccc(Br)c1.
What is the InChIKey of 2-(3-bromophenyl)-1-[2-[(2-methylpropan-2-yl)oxy]phenyl]imidazole?
The InChIKey is WOCIPXWYMSUJEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19BrN2O/c1-19(2,3)23-17-10-5-4-9-16(17)22-12-11-21-18(22)14-7-6-8-15(20)13-14/h4-13H,1-3H3.
What are the key properties of 2-(3-bromophenyl)-1-[2-[(2-methylpropan-2-yl)oxy]phenyl]imidazole?
2-(3-bromophenyl)-1-[2-[(2-methylpropan-2-yl)oxy]phenyl]imidazole has a molecular weight of 371.28 g/mol, XLogP of 5.48, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromophenyl)-1-[2-[(2-methylpropan-2-yl)oxy]phenyl]imidazole is sourced from PubChem (CID 58947187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).