6-(3-hydroxypropyl)-1H-pyridin-2-one

C8H11NO2 — CID 134854501

IUPAC6-(3-hydroxypropyl)-1H-pyridin-2-one
SMILESO=c1cccc(CCCO)[nH]1
InChIInChI=1S/C8H11NO2/c10-6-2-4-7-3-1-5-8(11)9-7/h1,3,5,10H,2,4,6H2,(H,9,11)
InChIKeyPOLVGHTUDPLZHC-UHFFFAOYSA-N
MW153.18 g/mol
LogP0.30
Rot. Bonds3

About 6-(3-hydroxypropyl)-1H-pyridin-2-one

6-(3-hydroxypropyl)-1H-pyridin-2-one (PubChem CID 134854501) has the molecular formula C8H11NO2 and a molecular weight of 153.18 g/mol. Its IUPAC name is 6-(3-hydroxypropyl)-1H-pyridin-2-one.

Molecular Properties

Compound Name6-(3-hydroxypropyl)-1H-pyridin-2-one
PubChem CID134854501
Molecular FormulaC8H11NO2
Molecular Weight153.18 g/mol
Exact Mass153.08
IUPAC Name6-(3-hydroxypropyl)-1H-pyridin-2-one
SMILESO=c1cccc(CCCO)[nH]1
InChIInChI=1S/C8H11NO2/c10-6-2-4-7-3-1-5-8(11)9-7/h1,3,5,10H,2,4,6H2,(H,9,11)
InChIKeyPOLVGHTUDPLZHC-UHFFFAOYSA-N
XLogP0.30
TPSA53.09 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(3-hydroxypropyl)-1H-pyridin-2-one?
The IUPAC name of 6-(3-hydroxypropyl)-1H-pyridin-2-one (CID 134854501) is 6-(3-hydroxypropyl)-1H-pyridin-2-one.
What is the SMILES notation for 6-(3-hydroxypropyl)-1H-pyridin-2-one?
The canonical SMILES for 6-(3-hydroxypropyl)-1H-pyridin-2-one is O=c1cccc(CCCO)[nH]1.
What is the InChIKey of 6-(3-hydroxypropyl)-1H-pyridin-2-one?
The InChIKey is POLVGHTUDPLZHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO2/c10-6-2-4-7-3-1-5-8(11)9-7/h1,3,5,10H,2,4,6H2,(H,9,11).
What are the key properties of 6-(3-hydroxypropyl)-1H-pyridin-2-one?
6-(3-hydroxypropyl)-1H-pyridin-2-one has a molecular weight of 153.18 g/mol, XLogP of 0.30, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-hydroxypropyl)-1H-pyridin-2-one is sourced from PubChem (CID 134854501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).