2-(2,5-dimethoxyphenyl)-2-propan-2-ylpyrrolidine

C15H23NO2 — CID 66465821

IUPAC2-(2,5-dimethoxyphenyl)-2-propan-2-ylpyrrolidine
SMILESCOc1ccc(OC)c(C2(C(C)C)CCCN2)c1
InChIInChI=1S/C15H23NO2/c1-11(2)15(8-5-9-16-15)13-10-12(17-3)6-7-14(13)18-4/h6-7,10-11,16H,5,8-9H2,1-4H3
InChIKeyPEYZKMGAPOYYCD-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.94
Rot. Bonds4

About 2-(2,5-dimethoxyphenyl)-2-propan-2-ylpyrrolidine

2-(2,5-dimethoxyphenyl)-2-propan-2-ylpyrrolidine (PubChem CID 66465821) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 2-(2,5-dimethoxyphenyl)-2-propan-2-ylpyrrolidine.

Molecular Properties

Compound Name2-(2,5-dimethoxyphenyl)-2-propan-2-ylpyrrolidine
PubChem CID66465821
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name2-(2,5-dimethoxyphenyl)-2-propan-2-ylpyrrolidine
SMILESCOc1ccc(OC)c(C2(C(C)C)CCCN2)c1
InChIInChI=1S/C15H23NO2/c1-11(2)15(8-5-9-16-15)13-10-12(17-3)6-7-14(13)18-4/h6-7,10-11,16H,5,8-9H2,1-4H3
InChIKeyPEYZKMGAPOYYCD-UHFFFAOYSA-N
XLogP2.94
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,4-dimethoxyphenyl)-2-propan-2-ylpyrrolidine
CID 66467199
2-(2-methoxy-3,4-dimethylphenyl)-2-propan-2-ylpyrrolidine
CID 103433658
2-propan-2-yl-2-(2,4,5-trimethylphenyl)pyrrolidine
CID 66467187
4-(2,5-dimethoxyphenyl)-4-methylpiperidine
CID 63156571
2-(5-methoxy-2-methylphenyl)-2-methylpyrrolidine
CID 117293900
4-methoxy-N,N-dimethyl-2-(2-methylpyrrolidin-2-yl)aniline
CID 117341086
2-(2-fluoro-5-methoxyphenyl)-2-methylpyrrolidine
CID 117298992
2-(2,4-dimethylphenyl)-2-propan-2-ylpyrrolidine
CID 66466956
2-(2,5-dimethylphenyl)-2-propan-2-ylpyrrolidine
CID 66465150
1-(2,5-dimethoxyphenyl)-2-methylcyclopentan-1-ol
CID 65049668
4-(2,5-dimethoxyphenyl)piperidine-4-carboxylic acid
CID 82091719
2-(5-methoxy-2-pyrrolidin-1-ylphenyl)-2-methylpyrrolidine
CID 117405565

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethoxyphenyl)-2-propan-2-ylpyrrolidine?
The IUPAC name of 2-(2,5-dimethoxyphenyl)-2-propan-2-ylpyrrolidine (CID 66465821) is 2-(2,5-dimethoxyphenyl)-2-propan-2-ylpyrrolidine.
What is the SMILES notation for 2-(2,5-dimethoxyphenyl)-2-propan-2-ylpyrrolidine?
The canonical SMILES for 2-(2,5-dimethoxyphenyl)-2-propan-2-ylpyrrolidine is COc1ccc(OC)c(C2(C(C)C)CCCN2)c1.
What is the InChIKey of 2-(2,5-dimethoxyphenyl)-2-propan-2-ylpyrrolidine?
The InChIKey is PEYZKMGAPOYYCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-11(2)15(8-5-9-16-15)13-10-12(17-3)6-7-14(13)18-4/h6-7,10-11,16H,5,8-9H2,1-4H3.
What are the key properties of 2-(2,5-dimethoxyphenyl)-2-propan-2-ylpyrrolidine?
2-(2,5-dimethoxyphenyl)-2-propan-2-ylpyrrolidine has a molecular weight of 249.35 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethoxyphenyl)-2-propan-2-ylpyrrolidine is sourced from PubChem (CID 66465821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).