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

C7H11NO2 — CID 59936977

IUPAC4-hydroxy-2,3-dimethyl-2,3-dihydro-1H-pyridin-6-one
SMILESCC1NC(=O)C=C(O)C1C
InChIInChI=1S/C7H11NO2/c1-4-5(2)8-7(10)3-6(4)9/h3-5,9H,1-2H3,(H,8,10)
InChIKeyYTBNGZLIAVIFGB-UHFFFAOYSA-N
MW141.17 g/mol
LogP0.58
Rot. Bonds

About 4-hydroxy-2,3-dimethyl-2,3-dihydro-1H-pyridin-6-one

4-hydroxy-2,3-dimethyl-2,3-dihydro-1H-pyridin-6-one (PubChem CID 59936977) has the molecular formula C7H11NO2 and a molecular weight of 141.17 g/mol. Its IUPAC name is 4-hydroxy-2,3-dimethyl-2,3-dihydro-1H-pyridin-6-one.

Molecular Properties

Compound Name4-hydroxy-2,3-dimethyl-2,3-dihydro-1H-pyridin-6-one
PubChem CID59936977
Molecular FormulaC7H11NO2
Molecular Weight141.17 g/mol
Exact Mass141.08
IUPAC Name4-hydroxy-2,3-dimethyl-2,3-dihydro-1H-pyridin-6-one
SMILESCC1NC(=O)C=C(O)C1C
InChIInChI=1S/C7H11NO2/c1-4-5(2)8-7(10)3-6(4)9/h3-5,9H,1-2H3,(H,8,10)
InChIKeyYTBNGZLIAVIFGB-UHFFFAOYSA-N
XLogP0.58
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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(2R)-4-hydroxy-2-propyl-2,3-dihydro-1H-pyridin-6-one
CID 54687257
4-Hydroxy-6-propyl-1,2,5,6-tetrahydropyridin-2-one
CID 54705604
4-Hydroxy-5-isopropyl-1,5-dihydro-pyrrol-2-one
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(2S)-2-tert-butyl-3-hydroxy-1,2-dihydropyrrol-5-one
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3-Hydroxy-2-(2-methylpropyl)-1,2-dihydropyrrol-5-one
CID 85685066
2-Butan-2-yl-3-hydroxy-1,2-dihydropyrrol-5-one
CID 91618641
4-hydroxy-2-propan-2-yl-2,3-dihydro-1H-pyridin-6-one
CID 137433281
(2R)-2-ethyl-3-hydroxy-1,2-dihydropyrrol-5-one
CID 138579820
N-(4-acetyl-5-hydroxycyclohexa-2,4-dien-1-yl)acetamide
CID 141931044
4-hydroxy-5-methyl-2-propan-2-yl-2,3-dihydro-1H-pyridin-6-one
CID 142450825

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-2,3-dimethyl-2,3-dihydro-1H-pyridin-6-one?
The IUPAC name of 4-hydroxy-2,3-dimethyl-2,3-dihydro-1H-pyridin-6-one (CID 59936977) is 4-hydroxy-2,3-dimethyl-2,3-dihydro-1H-pyridin-6-one.
What is the SMILES notation for 4-hydroxy-2,3-dimethyl-2,3-dihydro-1H-pyridin-6-one?
The canonical SMILES for 4-hydroxy-2,3-dimethyl-2,3-dihydro-1H-pyridin-6-one is CC1NC(=O)C=C(O)C1C.
What is the InChIKey of 4-hydroxy-2,3-dimethyl-2,3-dihydro-1H-pyridin-6-one?
The InChIKey is YTBNGZLIAVIFGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NO2/c1-4-5(2)8-7(10)3-6(4)9/h3-5,9H,1-2H3,(H,8,10).
What are the key properties of 4-hydroxy-2,3-dimethyl-2,3-dihydro-1H-pyridin-6-one?
4-hydroxy-2,3-dimethyl-2,3-dihydro-1H-pyridin-6-one has a molecular weight of 141.17 g/mol, XLogP of 0.58, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-2,3-dimethyl-2,3-dihydro-1H-pyridin-6-one is sourced from PubChem (CID 59936977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).