(2R)-2-(2,6-dimethoxyphenyl)-1-propylpyrrolidine

C15H23NO2 — CID 124500725

IUPAC(2R)-2-(2,6-dimethoxyphenyl)-1-propylpyrrolidine
SMILESCCCN1CCC[C@@H]1c1c(OC)cccc1OC
InChIInChI=1S/C15H23NO2/c1-4-10-16-11-6-7-12(16)15-13(17-2)8-5-9-14(15)18-3/h5,8-9,12H,4,6-7,10-11H2,1-3H3/t12-/m1/s1
InChIKeyIMXQRLABMNDHPZ-GFCCVEGCSA-N
MW249.35 g/mol
LogP3.25
Rot. Bonds5

About (2R)-2-(2,6-dimethoxyphenyl)-1-propylpyrrolidine

(2R)-2-(2,6-dimethoxyphenyl)-1-propylpyrrolidine (PubChem CID 124500725) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is (2R)-2-(2,6-dimethoxyphenyl)-1-propylpyrrolidine.

Molecular Properties

Compound Name(2R)-2-(2,6-dimethoxyphenyl)-1-propylpyrrolidine
PubChem CID124500725
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name(2R)-2-(2,6-dimethoxyphenyl)-1-propylpyrrolidine
SMILESCCCN1CCC[C@@H]1c1c(OC)cccc1OC
InChIInChI=1S/C15H23NO2/c1-4-10-16-11-6-7-12(16)15-13(17-2)8-5-9-14(15)18-3/h5,8-9,12H,4,6-7,10-11H2,1-3H3/t12-/m1/s1
InChIKeyIMXQRLABMNDHPZ-GFCCVEGCSA-N
XLogP3.25
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methoxyphenyl)-1-propylpiperidine
CID 102544278
(2R)-1-benzyl-2-(2,6-dimethoxyphenyl)pyrrolidine
CID 124500714
2-[(2S)-2-(2-methoxyphenyl)pyrrolidin-1-yl]ethanamine
CID 51657078
[2-(2-chloro-6-methoxyphenyl)-1-propylazepan-3-yl]methanamine
CID 104818727
6-methoxy-2-methyl-3-(1-propylpyrrolidin-2-yl)pyridine
CID 102542573
(3aR,9bS)-9-methoxy-3-propyl-1,2,3a,4,5,9b-hexahydrobenzo[e]indole;hydrochloride
CID 67720360
2-(4-fluorophenyl)-1-propylpyrrolidine
CID 102544448
2-ethoxy-3-(1-propylpyrrolidin-2-yl)pyridine
CID 102539384
6-methoxy-2-methyl-3-(1-propylpiperidin-2-yl)pyridine
CID 102542582
(2R)-2-(2,6-dimethoxyphenyl)piperidine-1-carbaldehyde
CID 124500754
7-methoxy-4-propyl-2,3,4a,5-tetrahydrothiochromeno[3,4-b]pyridine;hydrochloride
CID 14151719
(4aR,10bS)-7-bromo-10-methoxy-4-propyl-1,2,3,4a,5,10b-hexahydrochromeno[3,4-b]pyridine
CID 18603889

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2,6-dimethoxyphenyl)-1-propylpyrrolidine?
The IUPAC name of (2R)-2-(2,6-dimethoxyphenyl)-1-propylpyrrolidine (CID 124500725) is (2R)-2-(2,6-dimethoxyphenyl)-1-propylpyrrolidine.
What is the SMILES notation for (2R)-2-(2,6-dimethoxyphenyl)-1-propylpyrrolidine?
The canonical SMILES for (2R)-2-(2,6-dimethoxyphenyl)-1-propylpyrrolidine is CCCN1CCC[C@@H]1c1c(OC)cccc1OC.
What is the InChIKey of (2R)-2-(2,6-dimethoxyphenyl)-1-propylpyrrolidine?
The InChIKey is IMXQRLABMNDHPZ-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H23NO2/c1-4-10-16-11-6-7-12(16)15-13(17-2)8-5-9-14(15)18-3/h5,8-9,12H,4,6-7,10-11H2,1-3H3/t12-/m1/s1.
What are the key properties of (2R)-2-(2,6-dimethoxyphenyl)-1-propylpyrrolidine?
(2R)-2-(2,6-dimethoxyphenyl)-1-propylpyrrolidine has a molecular weight of 249.35 g/mol, XLogP of 3.25, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2,6-dimethoxyphenyl)-1-propylpyrrolidine is sourced from PubChem (CID 124500725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).