2-(6-bromonaphthalen-2-yl)oxy-N-(2-thiophen-2-ylethyl)acetamide

C18H16BrNO2S — CID 7604570

IUPAC2-(6-bromonaphthalen-2-yl)oxy-N-(2-thiophen-2-ylethyl)acetamide
SMILESO=C(COc1ccc2cc(Br)ccc2c1)NCCc1cccs1
InChIInChI=1S/C18H16BrNO2S/c19-15-5-3-14-11-16(6-4-13(14)10-15)22-12-18(21)20-8-7-17-2-1-9-23-17/h1-6,9-11H,7-8,12H2,(H,20,21)
InChIKeyBTNRSHYVWDQIEX-UHFFFAOYSA-N
MW390.30 g/mol
LogP4.40
Rot. Bonds6

About 2-(6-bromonaphthalen-2-yl)oxy-N-(2-thiophen-2-ylethyl)acetamide

2-(6-bromonaphthalen-2-yl)oxy-N-(2-thiophen-2-ylethyl)acetamide (PubChem CID 7604570) has the molecular formula C18H16BrNO2S and a molecular weight of 390.30 g/mol. Its IUPAC name is 2-(6-bromonaphthalen-2-yl)oxy-N-(2-thiophen-2-ylethyl)acetamide.

Molecular Properties

Compound Name2-(6-bromonaphthalen-2-yl)oxy-N-(2-thiophen-2-ylethyl)acetamide
PubChem CID7604570
Molecular FormulaC18H16BrNO2S
Molecular Weight390.30 g/mol
Exact Mass389.01
IUPAC Name2-(6-bromonaphthalen-2-yl)oxy-N-(2-thiophen-2-ylethyl)acetamide
SMILESO=C(COc1ccc2cc(Br)ccc2c1)NCCc1cccs1
InChIInChI=1S/C18H16BrNO2S/c19-15-5-3-14-11-16(6-4-13(14)10-15)22-12-18(21)20-8-7-17-2-1-9-23-17/h1-6,9-11H,7-8,12H2,(H,20,21)
InChIKeyBTNRSHYVWDQIEX-UHFFFAOYSA-N
XLogP4.40
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.30
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,4-dichlorophenoxy)-N-(2-thiophen-2-ylethyl)acetamide
CID 7604220
2-(2,3-dihydro-1H-inden-5-yloxy)-N-(2-thiophen-2-ylethyl)acetamide
CID 27770063
2-(2,6-dibromophenoxy)-N-(2-thiophen-2-ylethyl)acetamide
CID 47449504
2-(6-bromonaphthalen-2-yl)oxy-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 9231224
2-(6-bromonaphthalen-2-yl)oxy-N-(2-methylpropyl)acetamide
CID 3989542
2-(2-oxo-4-phenylchromen-7-yl)oxy-N-(2-thiophen-2-ylethyl)acetamide
CID 8951439
2-[[2-(6-bromonaphthalen-2-yl)oxyacetyl]amino]-N-ethylacetamide
CID 9231222
2-(2,6-dimethylphenoxy)-N-(2-thiophen-2-ylethyl)acetamide
CID 27770102
N-(3-hydroxy-3-thiophen-2-ylpropyl)-2-naphthalen-2-yloxyacetamide
CID 90524092
5-bromo-2-chloro-N-(2-thiophen-2-ylethyl)benzamide
CID 27770225
2-hydroxy-N-(2-thiophen-2-ylethyl)acetamide
CID 13454159
[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl] 2-(3-methyl-4-propan-2-ylphenoxy)acetate
CID 8951493

Frequently Asked Questions

What is the IUPAC name of 2-(6-bromonaphthalen-2-yl)oxy-N-(2-thiophen-2-ylethyl)acetamide?
The IUPAC name of 2-(6-bromonaphthalen-2-yl)oxy-N-(2-thiophen-2-ylethyl)acetamide (CID 7604570) is 2-(6-bromonaphthalen-2-yl)oxy-N-(2-thiophen-2-ylethyl)acetamide.
What is the SMILES notation for 2-(6-bromonaphthalen-2-yl)oxy-N-(2-thiophen-2-ylethyl)acetamide?
The canonical SMILES for 2-(6-bromonaphthalen-2-yl)oxy-N-(2-thiophen-2-ylethyl)acetamide is O=C(COc1ccc2cc(Br)ccc2c1)NCCc1cccs1.
What is the InChIKey of 2-(6-bromonaphthalen-2-yl)oxy-N-(2-thiophen-2-ylethyl)acetamide?
The InChIKey is BTNRSHYVWDQIEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16BrNO2S/c19-15-5-3-14-11-16(6-4-13(14)10-15)22-12-18(21)20-8-7-17-2-1-9-23-17/h1-6,9-11H,7-8,12H2,(H,20,21).
What are the key properties of 2-(6-bromonaphthalen-2-yl)oxy-N-(2-thiophen-2-ylethyl)acetamide?
2-(6-bromonaphthalen-2-yl)oxy-N-(2-thiophen-2-ylethyl)acetamide has a molecular weight of 390.30 g/mol, XLogP of 4.40, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-bromonaphthalen-2-yl)oxy-N-(2-thiophen-2-ylethyl)acetamide is sourced from PubChem (CID 7604570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).