1-(2-ethenylimino-1-pyridinyl)ethanone

C9H10N2O — CID 89211494

IUPAC1-(2-ethenylimino-1-pyridinyl)ethanone
SMILESC=C/N=c1\ccccn1C(C)=O
InChIInChI=1S/C9H10N2O/c1-3-10-9-6-4-5-7-11(9)8(2)12/h3-7H,1H2,2H3/b10-9+
InChIKeyLDASWLHPTBBNPE-MDZDMXLPSA-N
MW162.19 g/mol
LogP1.19
Rot. Bonds1

About 1-(2-ethenylimino-1-pyridinyl)ethanone

1-(2-ethenylimino-1-pyridinyl)ethanone (PubChem CID 89211494) has the molecular formula C9H10N2O and a molecular weight of 162.19 g/mol. Its IUPAC name is 1-(2-ethenylimino-1-pyridinyl)ethanone.

Molecular Properties

Compound Name1-(2-ethenylimino-1-pyridinyl)ethanone
PubChem CID89211494
Molecular FormulaC9H10N2O
Molecular Weight162.19 g/mol
Exact Mass162.08
IUPAC Name1-(2-ethenylimino-1-pyridinyl)ethanone
SMILESC=C/N=c1\ccccn1C(C)=O
InChIInChI=1S/C9H10N2O/c1-3-10-9-6-4-5-7-11(9)8(2)12/h3-7H,1H2,2H3/b10-9+
InChIKeyLDASWLHPTBBNPE-MDZDMXLPSA-N
XLogP1.19
TPSA34.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.19
LogP ≤ 51.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-ethenylimino-1-pyridinyl)ethanone?
The IUPAC name of 1-(2-ethenylimino-1-pyridinyl)ethanone (CID 89211494) is 1-(2-ethenylimino-1-pyridinyl)ethanone.
What is the SMILES notation for 1-(2-ethenylimino-1-pyridinyl)ethanone?
The canonical SMILES for 1-(2-ethenylimino-1-pyridinyl)ethanone is C=C/N=c1\ccccn1C(C)=O.
What is the InChIKey of 1-(2-ethenylimino-1-pyridinyl)ethanone?
The InChIKey is LDASWLHPTBBNPE-MDZDMXLPSA-N. The full InChI is InChI=1S/C9H10N2O/c1-3-10-9-6-4-5-7-11(9)8(2)12/h3-7H,1H2,2H3/b10-9+.
What are the key properties of 1-(2-ethenylimino-1-pyridinyl)ethanone?
1-(2-ethenylimino-1-pyridinyl)ethanone has a molecular weight of 162.19 g/mol, XLogP of 1.19, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethenylimino-1-pyridinyl)ethanone is sourced from PubChem (CID 89211494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).