4-hydroxy-1-(2-pyrrolidin-1-ylphenyl)pyrrolidin-2-one

C14H18N2O2 — CID 168703559

IUPAC4-hydroxy-1-(2-pyrrolidin-1-ylphenyl)pyrrolidin-2-one
SMILESO=C1CC(O)CN1c1ccccc1N1CCCC1
InChIInChI=1S/C14H18N2O2/c17-11-9-14(18)16(10-11)13-6-2-1-5-12(13)15-7-3-4-8-15/h1-2,5-6,11,17H,3-4,7-10H2
InChIKeyRZSDWTANMBUPIO-UHFFFAOYSA-N
MW246.31 g/mol
LogP1.38
Rot. Bonds2

About 4-hydroxy-1-(2-pyrrolidin-1-ylphenyl)pyrrolidin-2-one

4-hydroxy-1-(2-pyrrolidin-1-ylphenyl)pyrrolidin-2-one (PubChem CID 168703559) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 4-hydroxy-1-(2-pyrrolidin-1-ylphenyl)pyrrolidin-2-one.

Molecular Properties

Compound Name4-hydroxy-1-(2-pyrrolidin-1-ylphenyl)pyrrolidin-2-one
PubChem CID168703559
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name4-hydroxy-1-(2-pyrrolidin-1-ylphenyl)pyrrolidin-2-one
SMILESO=C1CC(O)CN1c1ccccc1N1CCCC1
InChIInChI=1S/C14H18N2O2/c17-11-9-14(18)16(10-11)13-6-2-1-5-12(13)15-7-3-4-8-15/h1-2,5-6,11,17H,3-4,7-10H2
InChIKeyRZSDWTANMBUPIO-UHFFFAOYSA-N
XLogP1.38
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-hydroxy-1-[2-(pyrrolidin-1-ylmethyl)phenyl]pyrrolidin-2-one
CID 168703708
(3R)-5-oxo-1-(2-piperidin-1-ylphenyl)pyrrolidine-3-carbonyl chloride
CID 94077588
4-ethynyl-1-(2-piperidin-1-ylphenyl)pyrrolidin-2-one
CID 168502435
methyl 5-oxo-1-(2-pyrrolidin-1-ylphenyl)pyrrolidine-3-carboxylate
CID 50879609
4-hydroxy-1-(2-pyrazol-1-ylphenyl)pyrrolidin-2-one
CID 168703552
methyl (3S)-5-oxo-1-(2-piperidin-1-ylphenyl)pyrrolidine-3-carboxylate
CID 94077585
1-[2-(aminomethyl)phenyl]-4-hydroxypyrrolidin-2-one
CID 168703041
1-(3-chloro-2-hydroxyphenyl)-4-hydroxypyrrolidin-2-one
CID 168703922
ethyl (3S)-5-oxo-1-(2-pyrrolidin-1-ylphenyl)pyrrolidine-3-carboxylate
CID 94077638
1-(8-chloronaphthalen-1-yl)-4-hydroxypyrrolidin-2-one
CID 168703739
4-(azidomethyl)-1-(2-pyrrolidin-1-ylphenyl)pyrrolidin-2-one
CID 168658001
2-bromo-6-(4-hydroxy-2-oxopyrrolidin-1-yl)benzoic acid
CID 168703891

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-1-(2-pyrrolidin-1-ylphenyl)pyrrolidin-2-one?
The IUPAC name of 4-hydroxy-1-(2-pyrrolidin-1-ylphenyl)pyrrolidin-2-one (CID 168703559) is 4-hydroxy-1-(2-pyrrolidin-1-ylphenyl)pyrrolidin-2-one.
What is the SMILES notation for 4-hydroxy-1-(2-pyrrolidin-1-ylphenyl)pyrrolidin-2-one?
The canonical SMILES for 4-hydroxy-1-(2-pyrrolidin-1-ylphenyl)pyrrolidin-2-one is O=C1CC(O)CN1c1ccccc1N1CCCC1.
What is the InChIKey of 4-hydroxy-1-(2-pyrrolidin-1-ylphenyl)pyrrolidin-2-one?
The InChIKey is RZSDWTANMBUPIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c17-11-9-14(18)16(10-11)13-6-2-1-5-12(13)15-7-3-4-8-15/h1-2,5-6,11,17H,3-4,7-10H2.
What are the key properties of 4-hydroxy-1-(2-pyrrolidin-1-ylphenyl)pyrrolidin-2-one?
4-hydroxy-1-(2-pyrrolidin-1-ylphenyl)pyrrolidin-2-one has a molecular weight of 246.31 g/mol, XLogP of 1.38, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-1-(2-pyrrolidin-1-ylphenyl)pyrrolidin-2-one is sourced from PubChem (CID 168703559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).