2-hydroxy-2,3-dihydro-1H-pyridin-6-one

C5H7NO2 — CID 90952935

IUPAC2-hydroxy-2,3-dihydro-1H-pyridin-6-one
SMILESO=C1C=CCC(O)N1
InChIInChI=1S/C5H7NO2/c7-4-2-1-3-5(8)6-4/h1-2,5,8H,3H2,(H,6,7)
InChIKeyOXFSUUDQBOMMBA-UHFFFAOYSA-N
MW113.12 g/mol
LogP-0.62
Rot. Bonds

About 2-hydroxy-2,3-dihydro-1H-pyridin-6-one

2-hydroxy-2,3-dihydro-1H-pyridin-6-one (PubChem CID 90952935) has the molecular formula C5H7NO2 and a molecular weight of 113.12 g/mol. Its IUPAC name is 2-hydroxy-2,3-dihydro-1H-pyridin-6-one.

Molecular Properties

Compound Name2-hydroxy-2,3-dihydro-1H-pyridin-6-one
PubChem CID90952935
Molecular FormulaC5H7NO2
Molecular Weight113.12 g/mol
Exact Mass113.05
IUPAC Name2-hydroxy-2,3-dihydro-1H-pyridin-6-one
SMILESO=C1C=CCC(O)N1
InChIInChI=1S/C5H7NO2/c7-4-2-1-3-5(8)6-4/h1-2,5,8H,3H2,(H,6,7)
InChIKeyOXFSUUDQBOMMBA-UHFFFAOYSA-N
XLogP-0.62
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.12
LogP ≤ 5-0.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-Dihydro-2,5,6-trihydroxypyridine
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cis-5,6-Dihydro-5,6-dihydroxy-2-hydroxypyridine
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2-(Hydroxymethyl)-1,2-dihydropyrrol-5-one
CID 15202861
(2S)-2-(hydroxymethyl)-1,2-dihydropyrrol-5-one
CID 15202862
(Z)-5-hydroxy-N-propylpent-2-enamide
CID 59032704
(Z)-5-hydroxy-N-methylpent-2-enamide
CID 59908916
5-hydroxy-N-methylpent-2-enamide
CID 72593636
N-(1-hydroxypropyl)but-2-enamide
CID 88267294
(E)-5-hydroxy-N-propan-2-ylpent-2-enamide
CID 102373395
(E)-5-hydroxy-N-methylpent-2-enamide
CID 124116276
(E)-N-(3-hydroxypropyl)pent-2-enamide
CID 127125502
3-(2-aminoethyl)-2-hydroxy-2,3-dihydro-1H-pyridin-6-one
CID 134319524

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-2,3-dihydro-1H-pyridin-6-one?
The IUPAC name of 2-hydroxy-2,3-dihydro-1H-pyridin-6-one (CID 90952935) is 2-hydroxy-2,3-dihydro-1H-pyridin-6-one.
What is the SMILES notation for 2-hydroxy-2,3-dihydro-1H-pyridin-6-one?
The canonical SMILES for 2-hydroxy-2,3-dihydro-1H-pyridin-6-one is O=C1C=CCC(O)N1.
What is the InChIKey of 2-hydroxy-2,3-dihydro-1H-pyridin-6-one?
The InChIKey is OXFSUUDQBOMMBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7NO2/c7-4-2-1-3-5(8)6-4/h1-2,5,8H,3H2,(H,6,7).
What are the key properties of 2-hydroxy-2,3-dihydro-1H-pyridin-6-one?
2-hydroxy-2,3-dihydro-1H-pyridin-6-one has a molecular weight of 113.12 g/mol, XLogP of -0.62, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2,3-dihydro-1H-pyridin-6-one is sourced from PubChem (CID 90952935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).