2,3-bis(ethenyl)-5-(hydroxymethyl)-1H-pyridin-4-one

C10H11NO2 — CID 142923204

IUPAC2,3-bis(ethenyl)-5-(hydroxymethyl)-1H-pyridin-4-one
SMILESC=Cc1[nH]cc(CO)c(=O)c1C=C
InChIInChI=1S/C10H11NO2/c1-3-8-9(4-2)11-5-7(6-12)10(8)13/h3-5,12H,1-2,6H2,(H,11,13)
InChIKeyGXIGOXRDCYFKLP-UHFFFAOYSA-N
MW177.20 g/mol
LogP1.15
Rot. Bonds3

About 2,3-bis(ethenyl)-5-(hydroxymethyl)-1H-pyridin-4-one

2,3-bis(ethenyl)-5-(hydroxymethyl)-1H-pyridin-4-one (PubChem CID 142923204) has the molecular formula C10H11NO2 and a molecular weight of 177.20 g/mol. Its IUPAC name is 2,3-bis(ethenyl)-5-(hydroxymethyl)-1H-pyridin-4-one.

Molecular Properties

Compound Name2,3-bis(ethenyl)-5-(hydroxymethyl)-1H-pyridin-4-one
PubChem CID142923204
Molecular FormulaC10H11NO2
Molecular Weight177.20 g/mol
Exact Mass177.08
IUPAC Name2,3-bis(ethenyl)-5-(hydroxymethyl)-1H-pyridin-4-one
SMILESC=Cc1[nH]cc(CO)c(=O)c1C=C
InChIInChI=1S/C10H11NO2/c1-3-8-9(4-2)11-5-7(6-12)10(8)13/h3-5,12H,1-2,6H2,(H,11,13)
InChIKeyGXIGOXRDCYFKLP-UHFFFAOYSA-N
XLogP1.15
TPSA53.09 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.20
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-bis(ethenyl)-4-ethyl-1H-pyrrole
CID 142984451
4-[4,5-bis(ethenyl)-1H-pyrrol-3-yl]but-1-en-2-amine
CID 144715193
ethane;2-ethenyl-4-ethyl-3-[(Z)-prop-1-enyl]-1H-pyrrole
CID 178090956
3-[5-ethenyl-4-[(Z)-prop-1-enyl]-1H-pyrrol-3-yl]propan-1-ol
CID 143749630
ethane;2-ethenyl-3,4-diethyl-1H-pyrrole
CID 177324812
3-hydroxy-5-(hydroxymethyl)-2-methyl-1H-pyridin-4-one
CID 593354
2,3-bis(ethenyl)-4-methyl-1H-pyrrole;ethane
CID 142006410
2,3-bis(ethenyl)-4-ethyl-1H-pyrrole;ethane;5-propan-2-yl-1H-imidazole
CID 145088276
3-[5-ethenyl-4-[(Z)-prop-1-enyl]-1H-pyrrol-3-yl]-2-methyl-2-(methylamino)propan-1-ol
CID 144556832
2-bromo-7-(hydroxymethyl)-5H-pyrido[3,2-d]pyrimidin-8-one
CID 135394367
[2,3-bis(ethenyl)-5-sulfanylphenyl]methanol
CID 145118793
bis(5-(hydroxymethyl)-1H-pyrimidine-2,4-dione);hydrate
CID 70550921

Frequently Asked Questions

What is the IUPAC name of 2,3-bis(ethenyl)-5-(hydroxymethyl)-1H-pyridin-4-one?
The IUPAC name of 2,3-bis(ethenyl)-5-(hydroxymethyl)-1H-pyridin-4-one (CID 142923204) is 2,3-bis(ethenyl)-5-(hydroxymethyl)-1H-pyridin-4-one.
What is the SMILES notation for 2,3-bis(ethenyl)-5-(hydroxymethyl)-1H-pyridin-4-one?
The canonical SMILES for 2,3-bis(ethenyl)-5-(hydroxymethyl)-1H-pyridin-4-one is C=Cc1[nH]cc(CO)c(=O)c1C=C.
What is the InChIKey of 2,3-bis(ethenyl)-5-(hydroxymethyl)-1H-pyridin-4-one?
The InChIKey is GXIGOXRDCYFKLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO2/c1-3-8-9(4-2)11-5-7(6-12)10(8)13/h3-5,12H,1-2,6H2,(H,11,13).
What are the key properties of 2,3-bis(ethenyl)-5-(hydroxymethyl)-1H-pyridin-4-one?
2,3-bis(ethenyl)-5-(hydroxymethyl)-1H-pyridin-4-one has a molecular weight of 177.20 g/mol, XLogP of 1.15, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-bis(ethenyl)-5-(hydroxymethyl)-1H-pyridin-4-one is sourced from PubChem (CID 142923204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).