1-(2-methoxy-1-phenylethyl)pyrrolidine

C13H19NO — CID 59124240

IUPAC1-(2-methoxy-1-phenylethyl)pyrrolidine
SMILESCOCC(c1ccccc1)N1CCCC1
InChIInChI=1S/C13H19NO/c1-15-11-13(14-9-5-6-10-14)12-7-3-2-4-8-12/h2-4,7-8,13H,5-6,9-11H2,1H3
InChIKeyHKZQJNQSKJKONV-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.47
Rot. Bonds4

About 1-(2-methoxy-1-phenylethyl)pyrrolidine

1-(2-methoxy-1-phenylethyl)pyrrolidine (PubChem CID 59124240) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 1-(2-methoxy-1-phenylethyl)pyrrolidine.

Molecular Properties

Compound Name1-(2-methoxy-1-phenylethyl)pyrrolidine
PubChem CID59124240
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name1-(2-methoxy-1-phenylethyl)pyrrolidine
SMILESCOCC(c1ccccc1)N1CCCC1
InChIInChI=1S/C13H19NO/c1-15-11-13(14-9-5-6-10-14)12-7-3-2-4-8-12/h2-4,7-8,13H,5-6,9-11H2,1H3
InChIKeyHKZQJNQSKJKONV-UHFFFAOYSA-N
XLogP2.47
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-(2-methoxy-1-phenylethyl)pyrrolidine 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-phenoxy-1-phenylethyl)pyrrolidine chloride
CID 21228853
1-[(1R)-1-phenylpropyl]azepane
CID 97315480
2-amino-3-methoxy-N-(2-phenyl-2-pyrrolidin-1-ylethyl)propanamide
CID 81071617
N-[[1-(2-methoxy-1-phenylethyl)piperidin-4-yl]methyl]ethanamine
CID 103465126
1-[(1S)-2-[(S)-methylsulfinyl]-1-phenylethyl]pyrrolidine
CID 10657531
1-(3-methyl-1-phenylbutyl)piperidine
CID 3056530
1-[(1S)-3-methyl-1-phenylbutyl]piperidine
CID 92967702
1-(3,3-dimethyl-1-phenylbutyl)pyrrolidine
CID 58442316
2-methoxy-N-(2-phenyl-2-piperidin-1-ylethyl)ethanesulfonamide
CID 110356277
1-(1-methoxypropan-2-yl)-2-(2-phenyl-2-pyrrolidin-1-ylethyl)guanidine
CID 111029818
N-ethyl-2-phenyl-2-pyrrolidin-1-ylethanamine
CID 43180882
(2-phenyl-2-piperidin-1-ylethyl) 2,2-diphenylacetate;hydrochloride
CID 86127745

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxy-1-phenylethyl)pyrrolidine?
The IUPAC name of 1-(2-methoxy-1-phenylethyl)pyrrolidine (CID 59124240) is 1-(2-methoxy-1-phenylethyl)pyrrolidine.
What is the SMILES notation for 1-(2-methoxy-1-phenylethyl)pyrrolidine?
The canonical SMILES for 1-(2-methoxy-1-phenylethyl)pyrrolidine is COCC(c1ccccc1)N1CCCC1.
What is the InChIKey of 1-(2-methoxy-1-phenylethyl)pyrrolidine?
The InChIKey is HKZQJNQSKJKONV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-15-11-13(14-9-5-6-10-14)12-7-3-2-4-8-12/h2-4,7-8,13H,5-6,9-11H2,1H3.
What are the key properties of 1-(2-methoxy-1-phenylethyl)pyrrolidine?
1-(2-methoxy-1-phenylethyl)pyrrolidine has a molecular weight of 205.30 g/mol, XLogP of 2.47, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxy-1-phenylethyl)pyrrolidine is sourced from PubChem (CID 59124240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).