2-cyano-N-(3-hydroxyphenyl)acetamide

C9H8N2O2 — CID 22099165

IUPAC2-cyano-N-(3-hydroxyphenyl)acetamide
SMILESN#CCC(=O)Nc1cccc(O)c1
InChIInChI=1S/C9H8N2O2/c10-5-4-9(13)11-7-2-1-3-8(12)6-7/h1-3,6,12H,4H2,(H,11,13)
InChIKeyZGBKOOIUDOQCKA-UHFFFAOYSA-N
MW176.17 g/mol
LogP1.24
Rot. Bonds2

About 2-cyano-N-(3-hydroxyphenyl)acetamide

2-cyano-N-(3-hydroxyphenyl)acetamide (PubChem CID 22099165) has the molecular formula C9H8N2O2 and a molecular weight of 176.17 g/mol. Its IUPAC name is 2-cyano-N-(3-hydroxyphenyl)acetamide.

Molecular Properties

Compound Name2-cyano-N-(3-hydroxyphenyl)acetamide
PubChem CID22099165
Molecular FormulaC9H8N2O2
Molecular Weight176.17 g/mol
Exact Mass176.06
IUPAC Name2-cyano-N-(3-hydroxyphenyl)acetamide
SMILESN#CCC(=O)Nc1cccc(O)c1
InChIInChI=1S/C9H8N2O2/c10-5-4-9(13)11-7-2-1-3-8(12)6-7/h1-3,6,12H,4H2,(H,11,13)
InChIKeyZGBKOOIUDOQCKA-UHFFFAOYSA-N
XLogP1.24
TPSA73.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.17
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-bromophenyl)-2-cyanoacetamide
CID 846049
2-cyano-N-[4-[(2-cyanoacetyl)amino]phenyl]acetamide
CID 5143928
2-cyano-N-[3-(3-methylphenyl)phenyl]acetamide
CID 168520968
2-cyano-N-(3-pyrimidin-2-ylphenyl)acetamide
CID 168521501
2-(4-cyanophenyl)-N-(3-hydroxyphenyl)acetamide
CID 103827428
2-cyano-N-[3-(1,1-difluoroethyl)phenyl]acetamide
CID 126785808
potassium;3-[(2-cyanoacetyl)amino]benzenesulfonic acid;hydride
CID 173377668
2-cyano-N-[3-[[2-(3-methylphenyl)acetyl]amino]phenyl]acetamide
CID 108922788
2-cyano-N-[3-(trifluoromethylsulfanyl)phenyl]acetamide
CID 168524340
N-(3-hydroxyphenyl)-2-(4-hydroxyphenyl)acetamide
CID 28878488
2-cyano-N-[3-[[2-(2-methoxyethoxy)acetyl]amino]phenyl]acetamide
CID 108922770
2-cyano-N-[3-(3,4-dimethylbenzoyl)phenyl]acetamide
CID 168520748

Frequently Asked Questions

What is the IUPAC name of 2-cyano-N-(3-hydroxyphenyl)acetamide?
The IUPAC name of 2-cyano-N-(3-hydroxyphenyl)acetamide (CID 22099165) is 2-cyano-N-(3-hydroxyphenyl)acetamide.
What is the SMILES notation for 2-cyano-N-(3-hydroxyphenyl)acetamide?
The canonical SMILES for 2-cyano-N-(3-hydroxyphenyl)acetamide is N#CCC(=O)Nc1cccc(O)c1.
What is the InChIKey of 2-cyano-N-(3-hydroxyphenyl)acetamide?
The InChIKey is ZGBKOOIUDOQCKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2O2/c10-5-4-9(13)11-7-2-1-3-8(12)6-7/h1-3,6,12H,4H2,(H,11,13).
What are the key properties of 2-cyano-N-(3-hydroxyphenyl)acetamide?
2-cyano-N-(3-hydroxyphenyl)acetamide has a molecular weight of 176.17 g/mol, XLogP of 1.24, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyano-N-(3-hydroxyphenyl)acetamide is sourced from PubChem (CID 22099165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).