2-(1-bromonaphthalen-2-yl)oxy-N-pyridin-3-ylacetamide

C17H13BrN2O2 — CID 1301094

IUPAC2-(1-bromonaphthalen-2-yl)oxy-N-pyridin-3-ylacetamide
SMILESO=C(COc1ccc2ccccc2c1Br)Nc1cccnc1
InChIInChI=1S/C17H13BrN2O2/c18-17-14-6-2-1-4-12(14)7-8-15(17)22-11-16(21)20-13-5-3-9-19-10-13/h1-10H,11H2,(H,20,21)
InChIKeyWLLRAGBPCSOJNH-UHFFFAOYSA-N
MW357.21 g/mol
LogP4.01
Rot. Bonds4

About 2-(1-bromonaphthalen-2-yl)oxy-N-pyridin-3-ylacetamide

2-(1-bromonaphthalen-2-yl)oxy-N-pyridin-3-ylacetamide (PubChem CID 1301094) has the molecular formula C17H13BrN2O2 and a molecular weight of 357.21 g/mol. Its IUPAC name is 2-(1-bromonaphthalen-2-yl)oxy-N-pyridin-3-ylacetamide.

Molecular Properties

Compound Name2-(1-bromonaphthalen-2-yl)oxy-N-pyridin-3-ylacetamide
PubChem CID1301094
Molecular FormulaC17H13BrN2O2
Molecular Weight357.21 g/mol
Exact Mass356.02
IUPAC Name2-(1-bromonaphthalen-2-yl)oxy-N-pyridin-3-ylacetamide
SMILESO=C(COc1ccc2ccccc2c1Br)Nc1cccnc1
InChIInChI=1S/C17H13BrN2O2/c18-17-14-6-2-1-4-12(14)7-8-15(17)22-11-16(21)20-13-5-3-9-19-10-13/h1-10H,11H2,(H,20,21)
InChIKeyWLLRAGBPCSOJNH-UHFFFAOYSA-N
XLogP4.01
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.21
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-naphthalen-2-yloxy-N-pyridin-4-ylacetamide
CID 823638
2-(2-bromo-4-ethylphenoxy)-N-(pyridin-4-yl)acetamide
CID 894100
N-(2-chloropyridin-3-yl)-2-(naphthalen-2-yloxy)acetamide
CID 1105286
2-(2-bromo-4-tert-butylphenoxy)-N-(pyridin-4-yl)acetamide
CID 2203155
2-(Naphthalen-2-yloxy)-N-(4-pyridin-4-ylmethyl-phenyl)-acetamide
CID 1075628
2-[4-(2-Bromobenzoyl)phenoxy]-N-(pyridin-3-YL)acetamide
CID 127042037
2-(4-bromo-2,5-dimethylphenoxy)-N-4-pyridinylacetamide
CID 1254286
2-[(1-bromo-2-naphthyl)oxy]-N-(2-pyridinylmethyl)acetamide
CID 1300205
N-ethyl-N-(6-methoxy-3-pyridinyl)-2-naphthalen-2-yloxyacetamide
CID 46883887
2-(4-phenylphenoxy)-N-pyridin-3-ylacetamide
CID 2332104
2-(Naphthalen-2-yloxy)-N-quinolin-8-yl-acetamide
CID 598857
(E)-N'-((1H-pyrrol-2-yl)methylene)-2-((1-bromonaphthalen-2-yl)oxy)acetohydrazide
CID 135643049

Frequently Asked Questions

What is the IUPAC name of 2-(1-bromonaphthalen-2-yl)oxy-N-pyridin-3-ylacetamide?
The IUPAC name of 2-(1-bromonaphthalen-2-yl)oxy-N-pyridin-3-ylacetamide (CID 1301094) is 2-(1-bromonaphthalen-2-yl)oxy-N-pyridin-3-ylacetamide.
What is the SMILES notation for 2-(1-bromonaphthalen-2-yl)oxy-N-pyridin-3-ylacetamide?
The canonical SMILES for 2-(1-bromonaphthalen-2-yl)oxy-N-pyridin-3-ylacetamide is O=C(COc1ccc2ccccc2c1Br)Nc1cccnc1.
What is the InChIKey of 2-(1-bromonaphthalen-2-yl)oxy-N-pyridin-3-ylacetamide?
The InChIKey is WLLRAGBPCSOJNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13BrN2O2/c18-17-14-6-2-1-4-12(14)7-8-15(17)22-11-16(21)20-13-5-3-9-19-10-13/h1-10H,11H2,(H,20,21).
What are the key properties of 2-(1-bromonaphthalen-2-yl)oxy-N-pyridin-3-ylacetamide?
2-(1-bromonaphthalen-2-yl)oxy-N-pyridin-3-ylacetamide has a molecular weight of 357.21 g/mol, XLogP of 4.01, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-bromonaphthalen-2-yl)oxy-N-pyridin-3-ylacetamide is sourced from PubChem (CID 1301094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).