1-[4-[1-(pyridin-2-ylamino)ethenyl]phenyl]ethanone

C15H14N2O — CID 144812192

IUPAC1-[4-[1-(pyridin-2-ylamino)ethenyl]phenyl]ethanone
SMILESC=C(Nc1ccccn1)c1ccc(C(C)=O)cc1
InChIInChI=1S/C15H14N2O/c1-11(17-15-5-3-4-10-16-15)13-6-8-14(9-7-13)12(2)18/h3-10H,1H2,2H3,(H,16,17)
InChIKeyJWAGQFSOZVPPKO-UHFFFAOYSA-N
MW238.29 g/mol
LogP3.37
Rot. Bonds4

About 1-[4-[1-(pyridin-2-ylamino)ethenyl]phenyl]ethanone

1-[4-[1-(pyridin-2-ylamino)ethenyl]phenyl]ethanone (PubChem CID 144812192) has the molecular formula C15H14N2O and a molecular weight of 238.29 g/mol. Its IUPAC name is 1-[4-[1-(pyridin-2-ylamino)ethenyl]phenyl]ethanone.

Molecular Properties

Compound Name1-[4-[1-(pyridin-2-ylamino)ethenyl]phenyl]ethanone
PubChem CID144812192
Molecular FormulaC15H14N2O
Molecular Weight238.29 g/mol
Exact Mass238.11
IUPAC Name1-[4-[1-(pyridin-2-ylamino)ethenyl]phenyl]ethanone
SMILESC=C(Nc1ccccn1)c1ccc(C(C)=O)cc1
InChIInChI=1S/C15H14N2O/c1-11(17-15-5-3-4-10-16-15)13-6-8-14(9-7-13)12(2)18/h3-10H,1H2,2H3,(H,16,17)
InChIKeyJWAGQFSOZVPPKO-UHFFFAOYSA-N
XLogP3.37
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

pyridine;N-pyridin-2-ylacetamide
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2-cyano-2-methyl-N-pyridin-2-ylpropanamide
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N,N'-dipyridin-2-ylbutanediamide
CID 3684644
2-(3-acetylphenoxy)-N-pyridin-2-ylacetamide
CID 82312002
4-ethynyl-N-pyridin-2-ylbenzamide
CID 135042338
1-hydroxy-3-pyridin-2-ylurea
CID 20612761
methyl 4-[[2-oxo-2-(pyridin-2-ylamino)acetyl]amino]benzoate
CID 108525910
4-(4-methylphenyl)-4-oxo-N-pyridin-2-ylbutanamide
CID 35034572
2-chloro-N-pyridin-2-ylpropanamide
CID 16789014
2-methylsulfanyl-N-pyridin-2-ylacetamide
CID 130725350

Frequently Asked Questions

What is the IUPAC name of 1-[4-[1-(pyridin-2-ylamino)ethenyl]phenyl]ethanone?
The IUPAC name of 1-[4-[1-(pyridin-2-ylamino)ethenyl]phenyl]ethanone (CID 144812192) is 1-[4-[1-(pyridin-2-ylamino)ethenyl]phenyl]ethanone.
What is the SMILES notation for 1-[4-[1-(pyridin-2-ylamino)ethenyl]phenyl]ethanone?
The canonical SMILES for 1-[4-[1-(pyridin-2-ylamino)ethenyl]phenyl]ethanone is C=C(Nc1ccccn1)c1ccc(C(C)=O)cc1.
What is the InChIKey of 1-[4-[1-(pyridin-2-ylamino)ethenyl]phenyl]ethanone?
The InChIKey is JWAGQFSOZVPPKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O/c1-11(17-15-5-3-4-10-16-15)13-6-8-14(9-7-13)12(2)18/h3-10H,1H2,2H3,(H,16,17).
What are the key properties of 1-[4-[1-(pyridin-2-ylamino)ethenyl]phenyl]ethanone?
1-[4-[1-(pyridin-2-ylamino)ethenyl]phenyl]ethanone has a molecular weight of 238.29 g/mol, XLogP of 3.37, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[1-(pyridin-2-ylamino)ethenyl]phenyl]ethanone is sourced from PubChem (CID 144812192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).