N-(6-bromonaphthalen-2-yl)-2-ethoxyacetamide

C14H14BrNO2 — CID 81003546

IUPACN-(6-bromonaphthalen-2-yl)-2-ethoxyacetamide
SMILESCCOCC(=O)Nc1ccc2cc(Br)ccc2c1
InChIInChI=1S/C14H14BrNO2/c1-2-18-9-14(17)16-13-6-4-10-7-12(15)5-3-11(10)8-13/h3-8H,2,9H2,1H3,(H,16,17)
InChIKeyTVNUNEOZKAVOOO-UHFFFAOYSA-N
MW308.18 g/mol
LogP3.58
Rot. Bonds4

About N-(6-bromonaphthalen-2-yl)-2-ethoxyacetamide

N-(6-bromonaphthalen-2-yl)-2-ethoxyacetamide (PubChem CID 81003546) has the molecular formula C14H14BrNO2 and a molecular weight of 308.18 g/mol. Its IUPAC name is N-(6-bromonaphthalen-2-yl)-2-ethoxyacetamide.

Molecular Properties

Compound NameN-(6-bromonaphthalen-2-yl)-2-ethoxyacetamide
PubChem CID81003546
Molecular FormulaC14H14BrNO2
Molecular Weight308.18 g/mol
Exact Mass307.02
IUPAC NameN-(6-bromonaphthalen-2-yl)-2-ethoxyacetamide
SMILESCCOCC(=O)Nc1ccc2cc(Br)ccc2c1
InChIInChI=1S/C14H14BrNO2/c1-2-18-9-14(17)16-13-6-4-10-7-12(15)5-3-11(10)8-13/h3-8H,2,9H2,1H3,(H,16,17)
InChIKeyTVNUNEOZKAVOOO-UHFFFAOYSA-N
XLogP3.58
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.18
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(6-bromonaphthalen-2-yl)oxy-N-naphthalen-2-ylacetamide
CID 7786811
N-(6-bromonaphthalen-2-yl)-3-methylbutanamide
CID 81259381
N-(6-bromonaphthalen-2-yl)-2-methylsulfanylacetamide
CID 81003623
N-(4-bromo-3-methoxyphenyl)-2-ethoxyacetamide
CID 79421127
2-(6-bromonaphthalen-2-yl)oxy-N-[4-(diethylamino)phenyl]acetamide
CID 3872632
2-(6-bromonaphthalen-2-yl)oxy-N-(3,5-dimethylphenyl)acetamide
CID 7786804
N-(6-bromonaphthalen-2-yl)-2-cyclopropylacetamide
CID 81004000
N-(4-bromo-3-nitrophenyl)-2-ethoxyacetamide
CID 79767714
3-(aminomethyl)-N-(6-bromonaphthalen-2-yl)pentanamide
CID 81260017
methyl 2-[(6-bromonaphthalen-2-yl)amino]-2-oxoacetate
CID 112617488
N-[3-(bromomethyl)phenyl]-2-ethoxyacetamide
CID 114307296
2-bromo-N-(6-bromonaphthalen-2-yl)butanamide
CID 81260484

Frequently Asked Questions

What is the IUPAC name of N-(6-bromonaphthalen-2-yl)-2-ethoxyacetamide?
The IUPAC name of N-(6-bromonaphthalen-2-yl)-2-ethoxyacetamide (CID 81003546) is N-(6-bromonaphthalen-2-yl)-2-ethoxyacetamide.
What is the SMILES notation for N-(6-bromonaphthalen-2-yl)-2-ethoxyacetamide?
The canonical SMILES for N-(6-bromonaphthalen-2-yl)-2-ethoxyacetamide is CCOCC(=O)Nc1ccc2cc(Br)ccc2c1.
What is the InChIKey of N-(6-bromonaphthalen-2-yl)-2-ethoxyacetamide?
The InChIKey is TVNUNEOZKAVOOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14BrNO2/c1-2-18-9-14(17)16-13-6-4-10-7-12(15)5-3-11(10)8-13/h3-8H,2,9H2,1H3,(H,16,17).
What are the key properties of N-(6-bromonaphthalen-2-yl)-2-ethoxyacetamide?
N-(6-bromonaphthalen-2-yl)-2-ethoxyacetamide has a molecular weight of 308.18 g/mol, XLogP of 3.58, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-bromonaphthalen-2-yl)-2-ethoxyacetamide is sourced from PubChem (CID 81003546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).