N-[2-(2H-pyridin-1-yl)ethenyl]acetamide

C9H12N2O — CID 155669274

IUPACN-[2-(2H-pyridin-1-yl)ethenyl]acetamide
SMILESCC(=O)NC=CN1C=CC=CC1
InChIInChI=1S/C9H12N2O/c1-9(12)10-5-8-11-6-3-2-4-7-11/h2-6,8H,7H2,1H3,(H,10,12)
InChIKeyOVRAZPCAYWZGLB-UHFFFAOYSA-N
MW164.21 g/mol
LogP0.98
Rot. Bonds2

About N-[2-(2H-pyridin-1-yl)ethenyl]acetamide

N-[2-(2H-pyridin-1-yl)ethenyl]acetamide (PubChem CID 155669274) has the molecular formula C9H12N2O and a molecular weight of 164.21 g/mol. Its IUPAC name is N-[2-(2H-pyridin-1-yl)ethenyl]acetamide.

Molecular Properties

Compound NameN-[2-(2H-pyridin-1-yl)ethenyl]acetamide
PubChem CID155669274
Molecular FormulaC9H12N2O
Molecular Weight164.21 g/mol
Exact Mass164.09
IUPAC NameN-[2-(2H-pyridin-1-yl)ethenyl]acetamide
SMILESCC(=O)NC=CN1C=CC=CC1
InChIInChI=1S/C9H12N2O/c1-9(12)10-5-8-11-6-3-2-4-7-11/h2-6,8H,7H2,1H3,(H,10,12)
InChIKeyOVRAZPCAYWZGLB-UHFFFAOYSA-N
XLogP0.98
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2H-pyridin-1-yl)ethenyl]acetamide?
The IUPAC name of N-[2-(2H-pyridin-1-yl)ethenyl]acetamide (CID 155669274) is N-[2-(2H-pyridin-1-yl)ethenyl]acetamide.
What is the SMILES notation for N-[2-(2H-pyridin-1-yl)ethenyl]acetamide?
The canonical SMILES for N-[2-(2H-pyridin-1-yl)ethenyl]acetamide is CC(=O)NC=CN1C=CC=CC1.
What is the InChIKey of N-[2-(2H-pyridin-1-yl)ethenyl]acetamide?
The InChIKey is OVRAZPCAYWZGLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O/c1-9(12)10-5-8-11-6-3-2-4-7-11/h2-6,8H,7H2,1H3,(H,10,12).
What are the key properties of N-[2-(2H-pyridin-1-yl)ethenyl]acetamide?
N-[2-(2H-pyridin-1-yl)ethenyl]acetamide has a molecular weight of 164.21 g/mol, XLogP of 0.98, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2H-pyridin-1-yl)ethenyl]acetamide is sourced from PubChem (CID 155669274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).