2-(3-bromo-2-phenylmethoxyphenyl)pyridine

C18H14BrNO — CID 151807224

IUPAC2-(3-bromo-2-phenylmethoxyphenyl)pyridine
SMILESBrc1cccc(-c2ccccn2)c1OCc1ccccc1
InChIInChI=1S/C18H14BrNO/c19-16-10-6-9-15(17-11-4-5-12-20-17)18(16)21-13-14-7-2-1-3-8-14/h1-12H,13H2
InChIKeyRZWASGJAVPALPG-UHFFFAOYSA-N
MW340.22 g/mol
LogP5.09
Rot. Bonds4

About 2-(3-bromo-2-phenylmethoxyphenyl)pyridine

2-(3-bromo-2-phenylmethoxyphenyl)pyridine (PubChem CID 151807224) has the molecular formula C18H14BrNO and a molecular weight of 340.22 g/mol. Its IUPAC name is 2-(3-bromo-2-phenylmethoxyphenyl)pyridine.

Molecular Properties

Compound Name2-(3-bromo-2-phenylmethoxyphenyl)pyridine
PubChem CID151807224
Molecular FormulaC18H14BrNO
Molecular Weight340.22 g/mol
Exact Mass339.03
IUPAC Name2-(3-bromo-2-phenylmethoxyphenyl)pyridine
SMILESBrc1cccc(-c2ccccn2)c1OCc1ccccc1
InChIInChI=1S/C18H14BrNO/c19-16-10-6-9-15(17-11-4-5-12-20-17)18(16)21-13-14-7-2-1-3-8-14/h1-12H,13H2
InChIKeyRZWASGJAVPALPG-UHFFFAOYSA-N
XLogP5.09
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.22
LogP ≤ 55.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[3-(1-phenylethenyl)-2-phenylmethoxyphenyl]pyridine
CID 58238539
(3-bromo-2-phenylmethoxyphenyl)methanamine;hydrochloride
CID 91799383
(3-bromo-2-phenylmethoxyphenyl)-phenylmethanone
CID 58238538
3-(3-bromo-2-phenylmethoxyphenyl)prop-2-enoic acid
CID 76899319
4-bromo-3-phenylmethoxypyridine-2-carboxylic acid;methane
CID 145157389
2-[2-(2-phenylethoxy)phenyl]pyridine
CID 102434679
2-naphthalen-1-ylpyridine;quinoxaline
CID 174357892
(2-pyridin-2-ylphenyl) selenohypobromite
CID 102165047
2-(3-bromo-5-methyl-2-phenylmethoxyphenyl)phenol
CID 20749744
2-(3-bromo-2-phenylmethoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CID 146035032
2-bromo-6-phenylmethoxyphenol
CID 67346586
2-methoxy-3-pyridin-2-ylaniline
CID 171626476

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromo-2-phenylmethoxyphenyl)pyridine?
The IUPAC name of 2-(3-bromo-2-phenylmethoxyphenyl)pyridine (CID 151807224) is 2-(3-bromo-2-phenylmethoxyphenyl)pyridine.
What is the SMILES notation for 2-(3-bromo-2-phenylmethoxyphenyl)pyridine?
The canonical SMILES for 2-(3-bromo-2-phenylmethoxyphenyl)pyridine is Brc1cccc(-c2ccccn2)c1OCc1ccccc1.
What is the InChIKey of 2-(3-bromo-2-phenylmethoxyphenyl)pyridine?
The InChIKey is RZWASGJAVPALPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14BrNO/c19-16-10-6-9-15(17-11-4-5-12-20-17)18(16)21-13-14-7-2-1-3-8-14/h1-12H,13H2.
What are the key properties of 2-(3-bromo-2-phenylmethoxyphenyl)pyridine?
2-(3-bromo-2-phenylmethoxyphenyl)pyridine has a molecular weight of 340.22 g/mol, XLogP of 5.09, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromo-2-phenylmethoxyphenyl)pyridine is sourced from PubChem (CID 151807224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).