[1-(2-phenoxyphenyl)pyrrolidin-3-yl]methanol

C17H19NO2 — CID 64865616

IUPAC[1-(2-phenoxyphenyl)pyrrolidin-3-yl]methanol
SMILESOCC1CCN(c2ccccc2Oc2ccccc2)C1
InChIInChI=1S/C17H19NO2/c19-13-14-10-11-18(12-14)16-8-4-5-9-17(16)20-15-6-2-1-3-7-15/h1-9,14,19H,10-13H2
InChIKeyAOQFWBNLZLDFPB-UHFFFAOYSA-N
MW269.34 g/mol
LogP3.30
Rot. Bonds4

About [1-(2-phenoxyphenyl)pyrrolidin-3-yl]methanol

[1-(2-phenoxyphenyl)pyrrolidin-3-yl]methanol (PubChem CID 64865616) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is [1-(2-phenoxyphenyl)pyrrolidin-3-yl]methanol.

Molecular Properties

Compound Name[1-(2-phenoxyphenyl)pyrrolidin-3-yl]methanol
PubChem CID64865616
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC Name[1-(2-phenoxyphenyl)pyrrolidin-3-yl]methanol
SMILESOCC1CCN(c2ccccc2Oc2ccccc2)C1
InChIInChI=1S/C17H19NO2/c19-13-14-10-11-18(12-14)16-8-4-5-9-17(16)20-15-6-2-1-3-7-15/h1-9,14,19H,10-13H2
InChIKeyAOQFWBNLZLDFPB-UHFFFAOYSA-N
XLogP3.30
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-(2-phenoxyphenyl)pyrrolidin-3-yl]methanol 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

N-methyl-1-(2-phenoxyphenyl)pyrrolidin-3-amine
CID 43315199
N-ethyl-1-(2-phenoxyphenyl)pyrrolidin-3-amine
CID 43315198
[(3S)-1-phenylpyrrolidin-3-yl]methanol
CID 42258987
N-methyl-1-(2-phenoxyphenyl)piperidin-4-amine
CID 43315200
[1-[2-(methoxymethyl)phenyl]pyrrolidin-3-yl]methanol
CID 64865830
[1-[2-(dimethylamino)phenyl]pyrrolidin-3-yl]methanol
CID 106760827
[1-(2-propan-2-ylphenyl)pyrrolidin-3-yl]methanol
CID 53215506
1-(2-phenoxyphenyl)piperazine
CID 12996705
(1R)-1-[2-[3-(hydroxymethyl)pyrrolidin-1-yl]phenyl]ethanol
CID 103942831
2-[1-(2-ethoxyphenyl)pyrrolidin-3-yl]ethanol
CID 117028471
(1R)-1-[2-[3-(hydroxymethyl)pyrrolidin-1-yl]-6-methoxyphenyl]ethanol
CID 113389249
[3-(hydroxymethyl)piperidin-1-yl]-(2-phenoxyphenyl)methanone
CID 110878410

Frequently Asked Questions

What is the IUPAC name of [1-(2-phenoxyphenyl)pyrrolidin-3-yl]methanol?
The IUPAC name of [1-(2-phenoxyphenyl)pyrrolidin-3-yl]methanol (CID 64865616) is [1-(2-phenoxyphenyl)pyrrolidin-3-yl]methanol.
What is the SMILES notation for [1-(2-phenoxyphenyl)pyrrolidin-3-yl]methanol?
The canonical SMILES for [1-(2-phenoxyphenyl)pyrrolidin-3-yl]methanol is OCC1CCN(c2ccccc2Oc2ccccc2)C1.
What is the InChIKey of [1-(2-phenoxyphenyl)pyrrolidin-3-yl]methanol?
The InChIKey is AOQFWBNLZLDFPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2/c19-13-14-10-11-18(12-14)16-8-4-5-9-17(16)20-15-6-2-1-3-7-15/h1-9,14,19H,10-13H2.
What are the key properties of [1-(2-phenoxyphenyl)pyrrolidin-3-yl]methanol?
[1-(2-phenoxyphenyl)pyrrolidin-3-yl]methanol has a molecular weight of 269.34 g/mol, XLogP of 3.30, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-phenoxyphenyl)pyrrolidin-3-yl]methanol is sourced from PubChem (CID 64865616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).