N-(2,2-dibromo-1-naphthalen-2-ylethenyl)acetamide

C14H11Br2NO — CID 165179674

IUPACN-(2,2-dibromo-1-naphthalen-2-ylethenyl)acetamide
SMILESCC(=O)NC(=C(Br)Br)c1ccc2ccccc2c1
InChIInChI=1S/C14H11Br2NO/c1-9(18)17-13(14(15)16)12-7-6-10-4-2-3-5-11(10)8-12/h2-8H,1H3,(H,17,18)
InChIKeyYFZLMGUEDQGXJH-UHFFFAOYSA-N
MW369.06 g/mol
LogP4.39
Rot. Bonds2

About N-(2,2-dibromo-1-naphthalen-2-ylethenyl)acetamide

N-(2,2-dibromo-1-naphthalen-2-ylethenyl)acetamide (PubChem CID 165179674) has the molecular formula C14H11Br2NO and a molecular weight of 369.06 g/mol. Its IUPAC name is N-(2,2-dibromo-1-naphthalen-2-ylethenyl)acetamide.

Molecular Properties

Compound NameN-(2,2-dibromo-1-naphthalen-2-ylethenyl)acetamide
PubChem CID165179674
Molecular FormulaC14H11Br2NO
Molecular Weight369.06 g/mol
Exact Mass366.92
IUPAC NameN-(2,2-dibromo-1-naphthalen-2-ylethenyl)acetamide
SMILESCC(=O)NC(=C(Br)Br)c1ccc2ccccc2c1
InChIInChI=1S/C14H11Br2NO/c1-9(18)17-13(14(15)16)12-7-6-10-4-2-3-5-11(10)8-12/h2-8H,1H3,(H,17,18)
InChIKeyYFZLMGUEDQGXJH-UHFFFAOYSA-N
XLogP4.39
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.06
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(Z)-4-naphthalen-2-yl-4-oxobut-2-en-2-yl]acetamide
CID 101486753
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N-(2-acetamidophenyl)naphthalene-2-carboxamide
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N-[(E)-but-2-en-2-yl]naphthalene-2-carboxamide
CID 173494224
dinaphthalen-2-ylmethanone
CID 10945915
1-naphthalen-2-yl-2-[4-(2-naphthalen-2-yl-2-oxoacetyl)phenyl]ethane-1,2-dione
CID 10939145
ethane;methyl naphthalene-2-carboxylate
CID 143895262
N-acetyl-6-bromonaphthalene-2-carboxamide
CID 115353964
2-methoxy-1-naphthalen-2-ylpropan-1-one
CID 79616176
3-naphthalen-2-ylbut-2-enoyl chloride
CID 91215732
naphthalene-2-carboxylic acid
CID 175967775
4-bromo-N-(1-naphthalen-2-ylethylideneamino)benzamide
CID 4299606

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dibromo-1-naphthalen-2-ylethenyl)acetamide?
The IUPAC name of N-(2,2-dibromo-1-naphthalen-2-ylethenyl)acetamide (CID 165179674) is N-(2,2-dibromo-1-naphthalen-2-ylethenyl)acetamide.
What is the SMILES notation for N-(2,2-dibromo-1-naphthalen-2-ylethenyl)acetamide?
The canonical SMILES for N-(2,2-dibromo-1-naphthalen-2-ylethenyl)acetamide is CC(=O)NC(=C(Br)Br)c1ccc2ccccc2c1.
What is the InChIKey of N-(2,2-dibromo-1-naphthalen-2-ylethenyl)acetamide?
The InChIKey is YFZLMGUEDQGXJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Br2NO/c1-9(18)17-13(14(15)16)12-7-6-10-4-2-3-5-11(10)8-12/h2-8H,1H3,(H,17,18).
What are the key properties of N-(2,2-dibromo-1-naphthalen-2-ylethenyl)acetamide?
N-(2,2-dibromo-1-naphthalen-2-ylethenyl)acetamide has a molecular weight of 369.06 g/mol, XLogP of 4.39, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dibromo-1-naphthalen-2-ylethenyl)acetamide is sourced from PubChem (CID 165179674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).