1-(3-hydroxyphenyl)pyrrolidin-2-one

C10H11NO2 — CID 736761

IUPAC1-(3-hydroxyphenyl)pyrrolidin-2-one
SMILESO=C1CCCN1c1cccc(O)c1
InChIInChI=1S/C10H11NO2/c12-9-4-1-3-8(7-9)11-6-2-5-10(11)13/h1,3-4,7,12H,2,5-6H2
InChIKeyYZVOLCQVEKXPHT-UHFFFAOYSA-N
MW177.20 g/mol
LogP1.52
Rot. Bonds1

About 1-(3-hydroxyphenyl)pyrrolidin-2-one

1-(3-hydroxyphenyl)pyrrolidin-2-one (PubChem CID 736761) has the molecular formula C10H11NO2 and a molecular weight of 177.20 g/mol. Its IUPAC name is 1-(3-hydroxyphenyl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-(3-hydroxyphenyl)pyrrolidin-2-one
PubChem CID736761
Molecular FormulaC10H11NO2
Molecular Weight177.20 g/mol
Exact Mass177.08
IUPAC Name1-(3-hydroxyphenyl)pyrrolidin-2-one
SMILESO=C1CCCN1c1cccc(O)c1
InChIInChI=1S/C10H11NO2/c12-9-4-1-3-8(7-9)11-6-2-5-10(11)13/h1,3-4,7,12H,2,5-6H2
InChIKeyYZVOLCQVEKXPHT-UHFFFAOYSA-N
XLogP1.52
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.20
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(3-hydroxyphenyl)pyrrolidin-2-one?
The IUPAC name of 1-(3-hydroxyphenyl)pyrrolidin-2-one (CID 736761) is 1-(3-hydroxyphenyl)pyrrolidin-2-one.
What is the SMILES notation for 1-(3-hydroxyphenyl)pyrrolidin-2-one?
The canonical SMILES for 1-(3-hydroxyphenyl)pyrrolidin-2-one is O=C1CCCN1c1cccc(O)c1.
What is the InChIKey of 1-(3-hydroxyphenyl)pyrrolidin-2-one?
The InChIKey is YZVOLCQVEKXPHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO2/c12-9-4-1-3-8(7-9)11-6-2-5-10(11)13/h1,3-4,7,12H,2,5-6H2.
What are the key properties of 1-(3-hydroxyphenyl)pyrrolidin-2-one?
1-(3-hydroxyphenyl)pyrrolidin-2-one has a molecular weight of 177.20 g/mol, XLogP of 1.52, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-hydroxyphenyl)pyrrolidin-2-one is sourced from PubChem (CID 736761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).