2-(3-benzyl-6-bromoimidazo[1,2-a]pyridin-2-yl)phenol

C20H15BrN2O — CID 122383815

IUPAC2-(3-benzyl-6-bromoimidazo[1,2-a]pyridin-2-yl)phenol
SMILESOc1ccccc1-c1nc2ccc(Br)cn2c1Cc1ccccc1
InChIInChI=1S/C20H15BrN2O/c21-15-10-11-19-22-20(16-8-4-5-9-18(16)24)17(23(19)13-15)12-14-6-2-1-3-7-14/h1-11,13,24H,12H2
InChIKeyMTJOTKZPMGMGFT-UHFFFAOYSA-N
MW379.26 g/mol
LogP5.06
Rot. Bonds3

About 2-(3-benzyl-6-bromoimidazo[1,2-a]pyridin-2-yl)phenol

2-(3-benzyl-6-bromoimidazo[1,2-a]pyridin-2-yl)phenol (PubChem CID 122383815) has the molecular formula C20H15BrN2O and a molecular weight of 379.26 g/mol. Its IUPAC name is 2-(3-benzyl-6-bromoimidazo[1,2-a]pyridin-2-yl)phenol.

Molecular Properties

Compound Name2-(3-benzyl-6-bromoimidazo[1,2-a]pyridin-2-yl)phenol
PubChem CID122383815
Molecular FormulaC20H15BrN2O
Molecular Weight379.26 g/mol
Exact Mass378.04
IUPAC Name2-(3-benzyl-6-bromoimidazo[1,2-a]pyridin-2-yl)phenol
SMILESOc1ccccc1-c1nc2ccc(Br)cn2c1Cc1ccccc1
InChIInChI=1S/C20H15BrN2O/c21-15-10-11-19-22-20(16-8-4-5-9-18(16)24)17(23(19)13-15)12-14-6-2-1-3-7-14/h1-11,13,24H,12H2
InChIKeyMTJOTKZPMGMGFT-UHFFFAOYSA-N
XLogP5.06
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500379.26
LogP ≤ 55.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-benzyl-6-bromo-2-propylimidazo[1,2-a]pyridine
CID 51360055
2-[6-bromo-3-[(3-chlorophenyl)methylamino]imidazo[1,2-a]pyridin-2-yl]phenol
CID 24821711
benzylbenzene;2-[2-(2-hydroxyphenyl)phenyl]phenol
CID 159586840
3-(6-bromo-2-phenylimidazo[1,2-a]pyridin-3-yl)propanoic acid
CID 39195795
6-bromo-2-(3-bromophenyl)-3-(thiophen-3-ylmethyl)imidazo[1,2-a]pyridine
CID 51361281
ethyl 2-(6-bromo-2-phenylimidazo[1,2-a]pyridin-3-yl)acetate
CID 11792775
6-bromo-2-naphthalen-1-ylimidazo[1,2-a]pyridin-3-amine
CID 63617250
4-bromo-2-[3-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]phenol
CID 71295574
2-[3-(4-bromoanilino)-6-methylimidazo[1,2-a]pyridin-2-yl]phenol
CID 118796411
6-bromo-2-phenylimidazo[1,2-a]pyridine-3-carboxylic acid
CID 113303487
6-bromo-2-(2-ethylphenyl)imidazo[1,2-a]pyridin-3-amine
CID 63616915
2-benzyl-6-bromo-N-(2,6-dimethylphenyl)imidazo[1,2-a]pyridin-3-amine
CID 3571494

Frequently Asked Questions

What is the IUPAC name of 2-(3-benzyl-6-bromoimidazo[1,2-a]pyridin-2-yl)phenol?
The IUPAC name of 2-(3-benzyl-6-bromoimidazo[1,2-a]pyridin-2-yl)phenol (CID 122383815) is 2-(3-benzyl-6-bromoimidazo[1,2-a]pyridin-2-yl)phenol.
What is the SMILES notation for 2-(3-benzyl-6-bromoimidazo[1,2-a]pyridin-2-yl)phenol?
The canonical SMILES for 2-(3-benzyl-6-bromoimidazo[1,2-a]pyridin-2-yl)phenol is Oc1ccccc1-c1nc2ccc(Br)cn2c1Cc1ccccc1.
What is the InChIKey of 2-(3-benzyl-6-bromoimidazo[1,2-a]pyridin-2-yl)phenol?
The InChIKey is MTJOTKZPMGMGFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15BrN2O/c21-15-10-11-19-22-20(16-8-4-5-9-18(16)24)17(23(19)13-15)12-14-6-2-1-3-7-14/h1-11,13,24H,12H2.
What are the key properties of 2-(3-benzyl-6-bromoimidazo[1,2-a]pyridin-2-yl)phenol?
2-(3-benzyl-6-bromoimidazo[1,2-a]pyridin-2-yl)phenol has a molecular weight of 379.26 g/mol, XLogP of 5.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-benzyl-6-bromoimidazo[1,2-a]pyridin-2-yl)phenol is sourced from PubChem (CID 122383815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).