N-(2-cyanophenyl)-2-(4,5-dicyanoimidazol-1-yl)acetamide

C14H8N6O — CID 115944720

IUPACN-(2-cyanophenyl)-2-(4,5-dicyanoimidazol-1-yl)acetamide
SMILESN#Cc1ccccc1NC(=O)Cn1cnc(C#N)c1C#N
InChIInChI=1S/C14H8N6O/c15-5-10-3-1-2-4-11(10)19-14(21)8-20-9-18-12(6-16)13(20)7-17/h1-4,9H,8H2,(H,19,21)
InChIKeyHGBKNCLIAPGDNS-UHFFFAOYSA-N
MW276.26 g/mol
LogP1.14
Rot. Bonds3

About N-(2-cyanophenyl)-2-(4,5-dicyanoimidazol-1-yl)acetamide

N-(2-cyanophenyl)-2-(4,5-dicyanoimidazol-1-yl)acetamide (PubChem CID 115944720) has the molecular formula C14H8N6O and a molecular weight of 276.26 g/mol. Its IUPAC name is N-(2-cyanophenyl)-2-(4,5-dicyanoimidazol-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-cyanophenyl)-2-(4,5-dicyanoimidazol-1-yl)acetamide
PubChem CID115944720
Molecular FormulaC14H8N6O
Molecular Weight276.26 g/mol
Exact Mass276.08
IUPAC NameN-(2-cyanophenyl)-2-(4,5-dicyanoimidazol-1-yl)acetamide
SMILESN#Cc1ccccc1NC(=O)Cn1cnc(C#N)c1C#N
InChIInChI=1S/C14H8N6O/c15-5-10-3-1-2-4-11(10)19-14(21)8-20-9-18-12(6-16)13(20)7-17/h1-4,9H,8H2,(H,19,21)
InChIKeyHGBKNCLIAPGDNS-UHFFFAOYSA-N
XLogP1.14
TPSA118.29 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.26
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-cyanophenyl)-2-(4-ethyl-6-oxopyrimidin-1-yl)acetamide
CID 121064373
N-(2-cyanophenyl)-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide
CID 798673
N-(2-cyanophenyl)-2-(6,8-diiodo-4-oxoquinazolin-3-yl)acetamide
CID 3616564
N-(2-cyanophenyl)-2-(2-oxo-1,3-thiazol-3-yl)acetamide
CID 63312447
N-(2-cyanophenyl)-2-(3-hydroxyazetidin-1-yl)acetamide
CID 63281967
N-(2-cyanophenyl)-2-(5-nitro-2-oxo-1-pyridinyl)acetamide
CID 7467854
N-(2-cyanophenyl)-3-hydroxypropanamide
CID 43165059
N-(2-cyanophenyl)-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide
CID 2443236
N-(2-cyanophenyl)-2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide
CID 2978535
2-[4-chloro-3-(difluoromethyl)-5-methylpyrazol-1-yl]-N-(2-cyanophenyl)acetamide
CID 19517544
N-(2-cyanophenyl)-2-(1,3-oxazol-4-yl)acetamide
CID 110686435
N-(2-cyanophenyl)-2-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide
CID 28564149

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanophenyl)-2-(4,5-dicyanoimidazol-1-yl)acetamide?
The IUPAC name of N-(2-cyanophenyl)-2-(4,5-dicyanoimidazol-1-yl)acetamide (CID 115944720) is N-(2-cyanophenyl)-2-(4,5-dicyanoimidazol-1-yl)acetamide.
What is the SMILES notation for N-(2-cyanophenyl)-2-(4,5-dicyanoimidazol-1-yl)acetamide?
The canonical SMILES for N-(2-cyanophenyl)-2-(4,5-dicyanoimidazol-1-yl)acetamide is N#Cc1ccccc1NC(=O)Cn1cnc(C#N)c1C#N.
What is the InChIKey of N-(2-cyanophenyl)-2-(4,5-dicyanoimidazol-1-yl)acetamide?
The InChIKey is HGBKNCLIAPGDNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8N6O/c15-5-10-3-1-2-4-11(10)19-14(21)8-20-9-18-12(6-16)13(20)7-17/h1-4,9H,8H2,(H,19,21).
What are the key properties of N-(2-cyanophenyl)-2-(4,5-dicyanoimidazol-1-yl)acetamide?
N-(2-cyanophenyl)-2-(4,5-dicyanoimidazol-1-yl)acetamide has a molecular weight of 276.26 g/mol, XLogP of 1.14, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanophenyl)-2-(4,5-dicyanoimidazol-1-yl)acetamide is sourced from PubChem (CID 115944720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).