6-hydroxy-5-propan-2-yl-1H-pyridin-2-one

C8H11NO2 — CID 119093189

IUPAC6-hydroxy-5-propan-2-yl-1H-pyridin-2-one
SMILESCC(C)c1ccc(=O)[nH]c1O
InChIInChI=1S/C8H11NO2/c1-5(2)6-3-4-7(10)9-8(6)11/h3-5H,1-2H3,(H2,9,10,11)
InChIKeyIECXJUVYACAGSO-UHFFFAOYSA-N
MW153.18 g/mol
LogP1.20
Rot. Bonds1

About 6-hydroxy-5-propan-2-yl-1H-pyridin-2-one

6-hydroxy-5-propan-2-yl-1H-pyridin-2-one (PubChem CID 119093189) has the molecular formula C8H11NO2 and a molecular weight of 153.18 g/mol. Its IUPAC name is 6-hydroxy-5-propan-2-yl-1H-pyridin-2-one.

Molecular Properties

Compound Name6-hydroxy-5-propan-2-yl-1H-pyridin-2-one
PubChem CID119093189
Molecular FormulaC8H11NO2
Molecular Weight153.18 g/mol
Exact Mass153.08
IUPAC Name6-hydroxy-5-propan-2-yl-1H-pyridin-2-one
SMILESCC(C)c1ccc(=O)[nH]c1O
InChIInChI=1S/C8H11NO2/c1-5(2)6-3-4-7(10)9-8(6)11/h3-5H,1-2H3,(H2,9,10,11)
InChIKeyIECXJUVYACAGSO-UHFFFAOYSA-N
XLogP1.20
TPSA53.09 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-hydroxy-5-propan-2-yl-1H-pyridin-2-one?
The IUPAC name of 6-hydroxy-5-propan-2-yl-1H-pyridin-2-one (CID 119093189) is 6-hydroxy-5-propan-2-yl-1H-pyridin-2-one.
What is the SMILES notation for 6-hydroxy-5-propan-2-yl-1H-pyridin-2-one?
The canonical SMILES for 6-hydroxy-5-propan-2-yl-1H-pyridin-2-one is CC(C)c1ccc(=O)[nH]c1O.
What is the InChIKey of 6-hydroxy-5-propan-2-yl-1H-pyridin-2-one?
The InChIKey is IECXJUVYACAGSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO2/c1-5(2)6-3-4-7(10)9-8(6)11/h3-5H,1-2H3,(H2,9,10,11).
What are the key properties of 6-hydroxy-5-propan-2-yl-1H-pyridin-2-one?
6-hydroxy-5-propan-2-yl-1H-pyridin-2-one has a molecular weight of 153.18 g/mol, XLogP of 1.20, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxy-5-propan-2-yl-1H-pyridin-2-one is sourced from PubChem (CID 119093189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).