N-(2-cyanophenyl)-2-methoxyacetamide

C10H10N2O2 — CID 1224046

IUPACN-(2-cyanophenyl)-2-methoxyacetamide
SMILESCOCC(=O)Nc1ccccc1C#N
InChIInChI=1S/C10H10N2O2/c1-14-7-10(13)12-9-5-3-2-4-8(9)6-11/h2-5H,7H2,1H3,(H,12,13)
InChIKeyQIXIFIGGCKPYNZ-UHFFFAOYSA-N
MW190.20 g/mol
LogP1.14
Rot. Bonds3

About N-(2-cyanophenyl)-2-methoxyacetamide

N-(2-cyanophenyl)-2-methoxyacetamide (PubChem CID 1224046) has the molecular formula C10H10N2O2 and a molecular weight of 190.20 g/mol. Its IUPAC name is N-(2-cyanophenyl)-2-methoxyacetamide.

Molecular Properties

Compound NameN-(2-cyanophenyl)-2-methoxyacetamide
PubChem CID1224046
Molecular FormulaC10H10N2O2
Molecular Weight190.20 g/mol
Exact Mass190.07
IUPAC NameN-(2-cyanophenyl)-2-methoxyacetamide
SMILESCOCC(=O)Nc1ccccc1C#N
InChIInChI=1S/C10H10N2O2/c1-14-7-10(13)12-9-5-3-2-4-8(9)6-11/h2-5H,7H2,1H3,(H,12,13)
InChIKeyQIXIFIGGCKPYNZ-UHFFFAOYSA-N
XLogP1.14
TPSA62.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.20
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyanophenyl)-2-methoxyacetamide?
The IUPAC name of N-(2-cyanophenyl)-2-methoxyacetamide (CID 1224046) is N-(2-cyanophenyl)-2-methoxyacetamide.
What is the SMILES notation for N-(2-cyanophenyl)-2-methoxyacetamide?
The canonical SMILES for N-(2-cyanophenyl)-2-methoxyacetamide is COCC(=O)Nc1ccccc1C#N.
What is the InChIKey of N-(2-cyanophenyl)-2-methoxyacetamide?
The InChIKey is QIXIFIGGCKPYNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2/c1-14-7-10(13)12-9-5-3-2-4-8(9)6-11/h2-5H,7H2,1H3,(H,12,13).
What are the key properties of N-(2-cyanophenyl)-2-methoxyacetamide?
N-(2-cyanophenyl)-2-methoxyacetamide has a molecular weight of 190.20 g/mol, XLogP of 1.14, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanophenyl)-2-methoxyacetamide is sourced from PubChem (CID 1224046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).