4-hydroxy-1-[4-(methoxymethyl)phenyl]pyrrolidin-2-one

C12H15NO3 — CID 168702249

IUPAC4-hydroxy-1-[4-(methoxymethyl)phenyl]pyrrolidin-2-one
SMILESCOCc1ccc(N2CC(O)CC2=O)cc1
InChIInChI=1S/C12H15NO3/c1-16-8-9-2-4-10(5-3-9)13-7-11(14)6-12(13)15/h2-5,11,14H,6-8H2,1H3
InChIKeyAATPHMGCUCZONA-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.93
Rot. Bonds3

About 4-hydroxy-1-[4-(methoxymethyl)phenyl]pyrrolidin-2-one

4-hydroxy-1-[4-(methoxymethyl)phenyl]pyrrolidin-2-one (PubChem CID 168702249) has the molecular formula C12H15NO3 and a molecular weight of 221.26 g/mol. Its IUPAC name is 4-hydroxy-1-[4-(methoxymethyl)phenyl]pyrrolidin-2-one.

Molecular Properties

Compound Name4-hydroxy-1-[4-(methoxymethyl)phenyl]pyrrolidin-2-one
PubChem CID168702249
Molecular FormulaC12H15NO3
Molecular Weight221.26 g/mol
Exact Mass221.11
IUPAC Name4-hydroxy-1-[4-(methoxymethyl)phenyl]pyrrolidin-2-one
SMILESCOCc1ccc(N2CC(O)CC2=O)cc1
InChIInChI=1S/C12H15NO3/c1-16-8-9-2-4-10(5-3-9)13-7-11(14)6-12(13)15/h2-5,11,14H,6-8H2,1H3
InChIKeyAATPHMGCUCZONA-UHFFFAOYSA-N
XLogP0.93
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-hydroxy-1-[4-(methoxymethyl)phenyl]pyrrolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-chloro-1-[4-(methoxymethyl)phenyl]pyrrolidin-2-one
CID 168687750
4-(4-hydroxy-2-oxopyrrolidin-1-yl)benzoic acid
CID 168703419
4-hydroxy-1-[4-(4-methylpiperazin-1-yl)phenyl]pyrrolidin-2-one
CID 168702108
4-hydroxy-1-[4-(1,2,4-triazol-1-ylmethyl)phenyl]pyrrolidin-2-one
CID 168703875
4-hydroxy-1-(4-hydroxy-3-methylphenyl)pyrrolidin-2-one
CID 168702485
4-hydroxy-1-[4-(2-methylphenoxy)phenyl]pyrrolidin-2-one
CID 168702567
methyl 2-hydroxy-4-(4-hydroxy-2-oxopyrrolidin-1-yl)benzoate
CID 168702194
methyl 1-[4-(2-methoxy-2-oxoethyl)phenyl]-5-oxopyrrolidine-3-carboxylate
CID 168693290
methyl (3S)-1-[4-[(4R)-4-methoxycarbonyl-2-oxopyrrolidin-1-yl]phenyl]-5-oxopyrrolidine-3-carboxylate
CID 94076246
methyl (3R)-1-[4-[(4-chlorophenyl)methoxy]phenyl]-5-oxopyrrolidine-3-carboxylate
CID 1272534
methyl 1-[4-[(4-chlorophenyl)methoxy]phenyl]-5-oxopyrrolidine-3-carboxylate
CID 5165669
4-hydroxy-1-[3-(2-methylprop-2-enoxy)phenyl]pyrrolidin-2-one
CID 168701900

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-1-[4-(methoxymethyl)phenyl]pyrrolidin-2-one?
The IUPAC name of 4-hydroxy-1-[4-(methoxymethyl)phenyl]pyrrolidin-2-one (CID 168702249) is 4-hydroxy-1-[4-(methoxymethyl)phenyl]pyrrolidin-2-one.
What is the SMILES notation for 4-hydroxy-1-[4-(methoxymethyl)phenyl]pyrrolidin-2-one?
The canonical SMILES for 4-hydroxy-1-[4-(methoxymethyl)phenyl]pyrrolidin-2-one is COCc1ccc(N2CC(O)CC2=O)cc1.
What is the InChIKey of 4-hydroxy-1-[4-(methoxymethyl)phenyl]pyrrolidin-2-one?
The InChIKey is AATPHMGCUCZONA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO3/c1-16-8-9-2-4-10(5-3-9)13-7-11(14)6-12(13)15/h2-5,11,14H,6-8H2,1H3.
What are the key properties of 4-hydroxy-1-[4-(methoxymethyl)phenyl]pyrrolidin-2-one?
4-hydroxy-1-[4-(methoxymethyl)phenyl]pyrrolidin-2-one has a molecular weight of 221.26 g/mol, XLogP of 0.93, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-1-[4-(methoxymethyl)phenyl]pyrrolidin-2-one is sourced from PubChem (CID 168702249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).