2-[(2S)-2-(2-methoxyphenyl)pyrrolidin-1-yl]ethanamine

C13H20N2O — CID 51657078

IUPAC2-[(2S)-2-(2-methoxyphenyl)pyrrolidin-1-yl]ethanamine
SMILESCOc1ccccc1[C@@H]1CCCN1CCN
InChIInChI=1S/C13H20N2O/c1-16-13-7-3-2-5-11(13)12-6-4-9-15(12)10-8-14/h2-3,5,7,12H,4,6,8-10,14H2,1H3/t12-/m0/s1
InChIKeyGSHJKQGKUVWUDF-LBPRGKRZSA-N
MW220.32 g/mol
LogP1.79
Rot. Bonds4

About 2-[(2S)-2-(2-methoxyphenyl)pyrrolidin-1-yl]ethanamine

2-[(2S)-2-(2-methoxyphenyl)pyrrolidin-1-yl]ethanamine (PubChem CID 51657078) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 2-[(2S)-2-(2-methoxyphenyl)pyrrolidin-1-yl]ethanamine.

Molecular Properties

Compound Name2-[(2S)-2-(2-methoxyphenyl)pyrrolidin-1-yl]ethanamine
PubChem CID51657078
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name2-[(2S)-2-(2-methoxyphenyl)pyrrolidin-1-yl]ethanamine
SMILESCOc1ccccc1[C@@H]1CCCN1CCN
InChIInChI=1S/C13H20N2O/c1-16-13-7-3-2-5-11(13)12-6-4-9-15(12)10-8-14/h2-3,5,7,12H,4,6,8-10,14H2,1H3/t12-/m0/s1
InChIKeyGSHJKQGKUVWUDF-LBPRGKRZSA-N
XLogP1.79
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[(2S)-2-(2-methoxyphenyl)pyrrolidin-1-yl]ethanamine 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

2-(2-methoxyphenyl)-1-propylpiperidine
CID 102544278
2-[3-(2-methoxyphenyl)pyrrolidin-1-yl]ethanamine
CID 23287971
(2S)-2-(2-methoxyphenyl)-1-propan-2-ylpyrrolidine
CID 124500769
(2R)-2-(2-methoxyphenyl)-1-propan-2-ylpyrrolidine
CID 124500768
(2R)-2-(2,6-dimethoxyphenyl)-1-propylpyrrolidine
CID 124500725
1-ethyl-3-[[2-(2-methoxyphenyl)pyrrolidin-1-yl]methyl]pyrazole
CID 91838829
2-[3-(2-methoxyphenyl)-2-methyl-3,4-dihydropyrazol-5-yl]ethanamine
CID 82072518
2-(2-phenylpiperidin-1-yl)ethanamine
CID 69157822
[4-(aminomethyl)phenyl]-[2-(2-methoxyphenyl)pyrrolidin-1-yl]methanone
CID 119316524
2-chloro-1-[2-(2-methoxyphenyl)pyrrolidin-1-yl]ethanone
CID 176997579
4-amino-1-[2-(2-methoxyphenyl)pyrrolidin-1-yl]pentan-1-one
CID 120562159
2-amino-1-[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]ethanone
CID 110096819

Frequently Asked Questions

What is the IUPAC name of 2-[(2S)-2-(2-methoxyphenyl)pyrrolidin-1-yl]ethanamine?
The IUPAC name of 2-[(2S)-2-(2-methoxyphenyl)pyrrolidin-1-yl]ethanamine (CID 51657078) is 2-[(2S)-2-(2-methoxyphenyl)pyrrolidin-1-yl]ethanamine.
What is the SMILES notation for 2-[(2S)-2-(2-methoxyphenyl)pyrrolidin-1-yl]ethanamine?
The canonical SMILES for 2-[(2S)-2-(2-methoxyphenyl)pyrrolidin-1-yl]ethanamine is COc1ccccc1[C@@H]1CCCN1CCN.
What is the InChIKey of 2-[(2S)-2-(2-methoxyphenyl)pyrrolidin-1-yl]ethanamine?
The InChIKey is GSHJKQGKUVWUDF-LBPRGKRZSA-N. The full InChI is InChI=1S/C13H20N2O/c1-16-13-7-3-2-5-11(13)12-6-4-9-15(12)10-8-14/h2-3,5,7,12H,4,6,8-10,14H2,1H3/t12-/m0/s1.
What are the key properties of 2-[(2S)-2-(2-methoxyphenyl)pyrrolidin-1-yl]ethanamine?
2-[(2S)-2-(2-methoxyphenyl)pyrrolidin-1-yl]ethanamine has a molecular weight of 220.32 g/mol, XLogP of 1.79, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2S)-2-(2-methoxyphenyl)pyrrolidin-1-yl]ethanamine is sourced from PubChem (CID 51657078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).