2-(4,5-dimethoxy-2,3-dimethylphenyl)-2-methylpyrrolidine

C15H23NO2 — CID 117377238

IUPAC2-(4,5-dimethoxy-2,3-dimethylphenyl)-2-methylpyrrolidine
SMILESCOc1cc(C2(C)CCCN2)c(C)c(C)c1OC
InChIInChI=1S/C15H23NO2/c1-10-11(2)14(18-5)13(17-4)9-12(10)15(3)7-6-8-16-15/h9,16H,6-8H2,1-5H3
InChIKeyDVIYNXSJNZEIDG-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.92
Rot. Bonds3

About 2-(4,5-dimethoxy-2,3-dimethylphenyl)-2-methylpyrrolidine

2-(4,5-dimethoxy-2,3-dimethylphenyl)-2-methylpyrrolidine (PubChem CID 117377238) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 2-(4,5-dimethoxy-2,3-dimethylphenyl)-2-methylpyrrolidine.

Molecular Properties

Compound Name2-(4,5-dimethoxy-2,3-dimethylphenyl)-2-methylpyrrolidine
PubChem CID117377238
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name2-(4,5-dimethoxy-2,3-dimethylphenyl)-2-methylpyrrolidine
SMILESCOc1cc(C2(C)CCCN2)c(C)c(C)c1OC
InChIInChI=1S/C15H23NO2/c1-10-11(2)14(18-5)13(17-4)9-12(10)15(3)7-6-8-16-15/h9,16H,6-8H2,1-5H3
InChIKeyDVIYNXSJNZEIDG-UHFFFAOYSA-N
XLogP2.92
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-fluoro-2,4,5-trimethoxyphenyl)-2-methylpyrrolidine
CID 117426521
2-(3-methoxy-2,4-dimethylphenyl)-2-methylpyrrolidine
CID 117313039
2-(5-methoxy-4-methyl-2-methylsulfonylphenyl)-2-methylpyrrolidine
CID 117455699
2-(2,4-dimethoxy-5-methylphenyl)-2-methylpyrrolidine
CID 117343013
2-(2-methoxy-5-methylphenyl)-2-methylpyrrolidine
CID 66467357
2-(2-fluoro-3,4-dimethoxy-5-methylphenyl)-2-methylpyrrolidine
CID 117386391
2-(2,4-dimethoxy-3-methylsulfanylphenyl)-2-methylpyrrolidine
CID 117422224
1-(4,5-dimethoxy-2,3-dimethylphenyl)cyclohexan-1-amine
CID 117413644
2-(2-cyclopropyloxy-5-fluoro-3-methoxyphenyl)-2-methylpyrrolidine
CID 117417338
2-(7-methoxy-2-methyl-1-benzofuran-4-yl)-2-methylpyrrolidine
CID 82622635
2-(2-bromo-5-methoxy-3-methylphenyl)-2-methylpyrrolidine
CID 117457126
2-(3,4-dimethoxy-2-propan-2-yloxyphenyl)-2-methylpyrrolidine
CID 117448348

Frequently Asked Questions

What is the IUPAC name of 2-(4,5-dimethoxy-2,3-dimethylphenyl)-2-methylpyrrolidine?
The IUPAC name of 2-(4,5-dimethoxy-2,3-dimethylphenyl)-2-methylpyrrolidine (CID 117377238) is 2-(4,5-dimethoxy-2,3-dimethylphenyl)-2-methylpyrrolidine.
What is the SMILES notation for 2-(4,5-dimethoxy-2,3-dimethylphenyl)-2-methylpyrrolidine?
The canonical SMILES for 2-(4,5-dimethoxy-2,3-dimethylphenyl)-2-methylpyrrolidine is COc1cc(C2(C)CCCN2)c(C)c(C)c1OC.
What is the InChIKey of 2-(4,5-dimethoxy-2,3-dimethylphenyl)-2-methylpyrrolidine?
The InChIKey is DVIYNXSJNZEIDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-10-11(2)14(18-5)13(17-4)9-12(10)15(3)7-6-8-16-15/h9,16H,6-8H2,1-5H3.
What are the key properties of 2-(4,5-dimethoxy-2,3-dimethylphenyl)-2-methylpyrrolidine?
2-(4,5-dimethoxy-2,3-dimethylphenyl)-2-methylpyrrolidine has a molecular weight of 249.35 g/mol, XLogP of 2.92, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,5-dimethoxy-2,3-dimethylphenyl)-2-methylpyrrolidine is sourced from PubChem (CID 117377238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).