2-bromo-N-(6-phenylmethoxy-3-pyridinyl)benzamide

C19H15BrN2O2 — CID 55879442

IUPAC2-bromo-N-(6-phenylmethoxy-3-pyridinyl)benzamide
SMILESO=C(Nc1ccc(OCc2ccccc2)nc1)c1ccccc1Br
InChIInChI=1S/C19H15BrN2O2/c20-17-9-5-4-8-16(17)19(23)22-15-10-11-18(21-12-15)24-13-14-6-2-1-3-7-14/h1-12H,13H2,(H,22,23)
InChIKeyPPQTVIYSSSGPBK-UHFFFAOYSA-N
MW383.25 g/mol
LogP4.68
Rot. Bonds5

About 2-bromo-N-(6-phenylmethoxy-3-pyridinyl)benzamide

2-bromo-N-(6-phenylmethoxy-3-pyridinyl)benzamide (PubChem CID 55879442) has the molecular formula C19H15BrN2O2 and a molecular weight of 383.25 g/mol. Its IUPAC name is 2-bromo-N-(6-phenylmethoxy-3-pyridinyl)benzamide.

Molecular Properties

Compound Name2-bromo-N-(6-phenylmethoxy-3-pyridinyl)benzamide
PubChem CID55879442
Molecular FormulaC19H15BrN2O2
Molecular Weight383.25 g/mol
Exact Mass382.03
IUPAC Name2-bromo-N-(6-phenylmethoxy-3-pyridinyl)benzamide
SMILESO=C(Nc1ccc(OCc2ccccc2)nc1)c1ccccc1Br
InChIInChI=1S/C19H15BrN2O2/c20-17-9-5-4-8-16(17)19(23)22-15-10-11-18(21-12-15)24-13-14-6-2-1-3-7-14/h1-12H,13H2,(H,22,23)
InChIKeyPPQTVIYSSSGPBK-UHFFFAOYSA-N
XLogP4.68
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.25
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(6-methoxy-3-pyridinyl)-2-phenylmethoxybenzamide
CID 2344191
2-bromo-N-(2-phenylpyrimidin-5-yl)benzamide
CID 27692565
2,6-dimethoxy-N-[(6-phenylmethoxy-3-pyridinyl)carbamoyl]benzamide
CID 12912868
N-(6-phenylmethoxy-3-pyridinyl)-4-(tetrazol-1-yl)benzamide
CID 55960600
N-(6-phenylmethoxy-3-pyridinyl)-3-(pyridin-3-ylmethoxy)benzamide
CID 55880084
2-bromo-N-(2-methoxypyrimidin-5-yl)benzamide
CID 122301734
2-bromo-N-[6-(4-fluoroanilino)-3-pyridinyl]benzamide
CID 113018308
2-bromo-N-[6-(tert-butylamino)-3-pyridinyl]benzamide
CID 113014773
2-bromo-N-[4-(hydroxymethyl)phenyl]benzamide
CID 64792802
5-(2-methylpropyl)-N-(6-phenylmethoxy-3-pyridinyl)-1H-pyrazole-3-carboxamide
CID 55993733
2-bromo-N-[6-(2-methoxyethoxy)-3-pyridinyl]pyridine-3-carboxamide
CID 103752362
2-bromo-N-[6-(furan-2-ylmethylamino)-3-pyridinyl]benzamide
CID 113011315

Frequently Asked Questions

What is the IUPAC name of 2-bromo-N-(6-phenylmethoxy-3-pyridinyl)benzamide?
The IUPAC name of 2-bromo-N-(6-phenylmethoxy-3-pyridinyl)benzamide (CID 55879442) is 2-bromo-N-(6-phenylmethoxy-3-pyridinyl)benzamide.
What is the SMILES notation for 2-bromo-N-(6-phenylmethoxy-3-pyridinyl)benzamide?
The canonical SMILES for 2-bromo-N-(6-phenylmethoxy-3-pyridinyl)benzamide is O=C(Nc1ccc(OCc2ccccc2)nc1)c1ccccc1Br.
What is the InChIKey of 2-bromo-N-(6-phenylmethoxy-3-pyridinyl)benzamide?
The InChIKey is PPQTVIYSSSGPBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15BrN2O2/c20-17-9-5-4-8-16(17)19(23)22-15-10-11-18(21-12-15)24-13-14-6-2-1-3-7-14/h1-12H,13H2,(H,22,23).
What are the key properties of 2-bromo-N-(6-phenylmethoxy-3-pyridinyl)benzamide?
2-bromo-N-(6-phenylmethoxy-3-pyridinyl)benzamide has a molecular weight of 383.25 g/mol, XLogP of 4.68, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-(6-phenylmethoxy-3-pyridinyl)benzamide is sourced from PubChem (CID 55879442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).