N-(2,6-dicyanophenyl)acetamide

C10H7N3O — CID 151583122

IUPACN-(2,6-dicyanophenyl)acetamide
SMILESCC(=O)Nc1c(C#N)cccc1C#N
InChIInChI=1S/C10H7N3O/c1-7(14)13-10-8(5-11)3-2-4-9(10)6-12/h2-4H,1H3,(H,13,14)
InChIKeyQGXLSXHQRMJHPY-UHFFFAOYSA-N
MW185.19 g/mol
LogP1.39
Rot. Bonds1

About N-(2,6-dicyanophenyl)acetamide

N-(2,6-dicyanophenyl)acetamide (PubChem CID 151583122) has the molecular formula C10H7N3O and a molecular weight of 185.19 g/mol. Its IUPAC name is N-(2,6-dicyanophenyl)acetamide.

Molecular Properties

Compound NameN-(2,6-dicyanophenyl)acetamide
PubChem CID151583122
Molecular FormulaC10H7N3O
Molecular Weight185.19 g/mol
Exact Mass185.06
IUPAC NameN-(2,6-dicyanophenyl)acetamide
SMILESCC(=O)Nc1c(C#N)cccc1C#N
InChIInChI=1S/C10H7N3O/c1-7(14)13-10-8(5-11)3-2-4-9(10)6-12/h2-4H,1H3,(H,13,14)
InChIKeyQGXLSXHQRMJHPY-UHFFFAOYSA-N
XLogP1.39
TPSA76.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.19
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

acetic acid;benzene-1,2-dicarbonitrile;molecular nitrogen
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N-(3,4-dicyanophenyl)acetamide
CID 12938829
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CID 107468131
1-(2-cyanophenyl)-3-(2,6-dimethylphenyl)urea
CID 108991418
N-(2-cyano-6-methoxyphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 107467908
N-[2-(2-amino-3-cyanophenoxy)phenyl]acetamide
CID 104717151
3-acetyl-2-aminobenzonitrile
CID 45086189
N-(5-cyano-4-nitronaphthalen-1-yl)acetamide
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Frequently Asked Questions

What is the IUPAC name of N-(2,6-dicyanophenyl)acetamide?
The IUPAC name of N-(2,6-dicyanophenyl)acetamide (CID 151583122) is N-(2,6-dicyanophenyl)acetamide.
What is the SMILES notation for N-(2,6-dicyanophenyl)acetamide?
The canonical SMILES for N-(2,6-dicyanophenyl)acetamide is CC(=O)Nc1c(C#N)cccc1C#N.
What is the InChIKey of N-(2,6-dicyanophenyl)acetamide?
The InChIKey is QGXLSXHQRMJHPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7N3O/c1-7(14)13-10-8(5-11)3-2-4-9(10)6-12/h2-4H,1H3,(H,13,14).
What are the key properties of N-(2,6-dicyanophenyl)acetamide?
N-(2,6-dicyanophenyl)acetamide has a molecular weight of 185.19 g/mol, XLogP of 1.39, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dicyanophenyl)acetamide is sourced from PubChem (CID 151583122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).