N-[(E)-2-(2-hydroxyphenyl)ethenyl]formamide

C9H9NO2 — CID 5386499

IUPACN-[(E)-2-(2-hydroxyphenyl)ethenyl]formamide
SMILESO=CN/C=C/c1ccccc1O
InChIInChI=1S/C9H9NO2/c11-7-10-6-5-8-3-1-2-4-9(8)12/h1-7,12H,(H,10,11)/b6-5+
InChIKeyWVTQKUWNFOBATC-AATRIKPKSA-N
MW163.18 g/mol
LogP1.11
Rot. Bonds3

About N-[(E)-2-(2-hydroxyphenyl)ethenyl]formamide

N-[(E)-2-(2-hydroxyphenyl)ethenyl]formamide (PubChem CID 5386499) has the molecular formula C9H9NO2 and a molecular weight of 163.18 g/mol. Its IUPAC name is N-[(E)-2-(2-hydroxyphenyl)ethenyl]formamide.

Molecular Properties

Compound NameN-[(E)-2-(2-hydroxyphenyl)ethenyl]formamide
PubChem CID5386499
Molecular FormulaC9H9NO2
Molecular Weight163.18 g/mol
Exact Mass163.06
IUPAC NameN-[(E)-2-(2-hydroxyphenyl)ethenyl]formamide
SMILESO=CN/C=C/c1ccccc1O
InChIInChI=1S/C9H9NO2/c11-7-10-6-5-8-3-1-2-4-9(8)12/h1-7,12H,(H,10,11)/b6-5+
InChIKeyWVTQKUWNFOBATC-AATRIKPKSA-N
XLogP1.11
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.18
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[(E)-2-(2-hydroxyphenyl)ethenyl]formamide?
The IUPAC name of N-[(E)-2-(2-hydroxyphenyl)ethenyl]formamide (CID 5386499) is N-[(E)-2-(2-hydroxyphenyl)ethenyl]formamide.
What is the SMILES notation for N-[(E)-2-(2-hydroxyphenyl)ethenyl]formamide?
The canonical SMILES for N-[(E)-2-(2-hydroxyphenyl)ethenyl]formamide is O=CN/C=C/c1ccccc1O.
What is the InChIKey of N-[(E)-2-(2-hydroxyphenyl)ethenyl]formamide?
The InChIKey is WVTQKUWNFOBATC-AATRIKPKSA-N. The full InChI is InChI=1S/C9H9NO2/c11-7-10-6-5-8-3-1-2-4-9(8)12/h1-7,12H,(H,10,11)/b6-5+.
What are the key properties of N-[(E)-2-(2-hydroxyphenyl)ethenyl]formamide?
N-[(E)-2-(2-hydroxyphenyl)ethenyl]formamide has a molecular weight of 163.18 g/mol, XLogP of 1.11, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-2-(2-hydroxyphenyl)ethenyl]formamide is sourced from PubChem (CID 5386499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).