1-[2-[2-(3-aminopropyl)phenoxy]ethyl]pyrrolidin-2-one

C15H22N2O2 — CID 170879211

IUPAC1-[2-[2-(3-aminopropyl)phenoxy]ethyl]pyrrolidin-2-one
SMILESNCCCc1ccccc1OCCN1CCCC1=O
InChIInChI=1S/C15H22N2O2/c16-9-3-6-13-5-1-2-7-14(13)19-12-11-17-10-4-8-15(17)18/h1-2,5,7H,3-4,6,8-12,16H2
InChIKeyOCXPGHQGCJZTIP-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.58
Rot. Bonds7

About 1-[2-[2-(3-aminopropyl)phenoxy]ethyl]pyrrolidin-2-one

1-[2-[2-(3-aminopropyl)phenoxy]ethyl]pyrrolidin-2-one (PubChem CID 170879211) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 1-[2-[2-(3-aminopropyl)phenoxy]ethyl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-[2-[2-(3-aminopropyl)phenoxy]ethyl]pyrrolidin-2-one
PubChem CID170879211
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name1-[2-[2-(3-aminopropyl)phenoxy]ethyl]pyrrolidin-2-one
SMILESNCCCc1ccccc1OCCN1CCCC1=O
InChIInChI=1S/C15H22N2O2/c16-9-3-6-13-5-1-2-7-14(13)19-12-11-17-10-4-8-15(17)18/h1-2,5,7H,3-4,6,8-12,16H2
InChIKeyOCXPGHQGCJZTIP-UHFFFAOYSA-N
XLogP1.58
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[2-[2-(3-aminopropyl)phenoxy]ethyl]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

1-[2-[2-(aminomethyl)phenoxy]ethyl]piperidin-2-one
CID 43253927
1-[2-(2-methanehydrazonoylphenoxy)ethyl]pyrrolidin-2-one
CID 168530961
1-[2-(2-acetylphenoxy)ethyl]pyrrolidin-2-one
CID 62019351
1-[2-[2-[(1R)-1-amino-2-hydroxyethyl]phenoxy]ethyl]pyrrolidin-2-one
CID 66515853
2-[[2-[2-(2-oxopyrrolidin-1-yl)ethoxy]phenyl]methylideneamino]guanidine
CID 168591840
1-[2-[2-(3-aminopropoxy)ethoxy]ethyl]pyrrolidin-2-one
CID 71094030
4-[2-[2-(aminomethyl)phenoxy]ethyl]morpholin-3-one
CID 79468945
1-[2-(4-phenylphenoxy)ethyl]pyrrolidin-2-one
CID 94702209
1-[2-(4-phenoxyphenoxy)ethyl]pyrrolidin-2-one
CID 94711360
1-(2-phenoxyethyl)azepan-2-one
CID 10513813
1-(2-naphthalen-2-yloxyethyl)pyrrolidin-2-one
CID 82132102
1-[3-(5,6,7,8-tetrahydronaphthalen-1-yloxy)propyl]pyrrolidin-2-one
CID 94698119

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-(3-aminopropyl)phenoxy]ethyl]pyrrolidin-2-one?
The IUPAC name of 1-[2-[2-(3-aminopropyl)phenoxy]ethyl]pyrrolidin-2-one (CID 170879211) is 1-[2-[2-(3-aminopropyl)phenoxy]ethyl]pyrrolidin-2-one.
What is the SMILES notation for 1-[2-[2-(3-aminopropyl)phenoxy]ethyl]pyrrolidin-2-one?
The canonical SMILES for 1-[2-[2-(3-aminopropyl)phenoxy]ethyl]pyrrolidin-2-one is NCCCc1ccccc1OCCN1CCCC1=O.
What is the InChIKey of 1-[2-[2-(3-aminopropyl)phenoxy]ethyl]pyrrolidin-2-one?
The InChIKey is OCXPGHQGCJZTIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c16-9-3-6-13-5-1-2-7-14(13)19-12-11-17-10-4-8-15(17)18/h1-2,5,7H,3-4,6,8-12,16H2.
What are the key properties of 1-[2-[2-(3-aminopropyl)phenoxy]ethyl]pyrrolidin-2-one?
1-[2-[2-(3-aminopropyl)phenoxy]ethyl]pyrrolidin-2-one has a molecular weight of 262.35 g/mol, XLogP of 1.58, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-(3-aminopropyl)phenoxy]ethyl]pyrrolidin-2-one is sourced from PubChem (CID 170879211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).