1-(2,5-dimethoxyphenyl)-N,5,5-trimethylpyrrolidin-3-amine

C15H24N2O2 — CID 117018248

IUPAC1-(2,5-dimethoxyphenyl)-N,5,5-trimethylpyrrolidin-3-amine
SMILESCNC1CN(c2cc(OC)ccc2OC)C(C)(C)C1
InChIInChI=1S/C15H24N2O2/c1-15(2)9-11(16-3)10-17(15)13-8-12(18-4)6-7-14(13)19-5/h6-8,11,16H,9-10H2,1-5H3
InChIKeyIAPULZBVAHIFPX-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.28
Rot. Bonds4

About 1-(2,5-dimethoxyphenyl)-N,5,5-trimethylpyrrolidin-3-amine

1-(2,5-dimethoxyphenyl)-N,5,5-trimethylpyrrolidin-3-amine (PubChem CID 117018248) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-(2,5-dimethoxyphenyl)-N,5,5-trimethylpyrrolidin-3-amine.

Molecular Properties

Compound Name1-(2,5-dimethoxyphenyl)-N,5,5-trimethylpyrrolidin-3-amine
PubChem CID117018248
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name1-(2,5-dimethoxyphenyl)-N,5,5-trimethylpyrrolidin-3-amine
SMILESCNC1CN(c2cc(OC)ccc2OC)C(C)(C)C1
InChIInChI=1S/C15H24N2O2/c1-15(2)9-11(16-3)10-17(15)13-8-12(18-4)6-7-14(13)19-5/h6-8,11,16H,9-10H2,1-5H3
InChIKeyIAPULZBVAHIFPX-UHFFFAOYSA-N
XLogP2.28
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2,5-dimethoxyphenyl)-N-methylpiperidin-4-amine
CID 43315071
1-(2,5-dimethoxyphenyl)-5,5-dimethylpyrrolidin-3-one
CID 117018058
[1-(2,4-dimethoxyphenyl)-5,5-dimethylpyrrolidin-3-yl]methanamine
CID 117018796
1-(2,5-dimethoxyphenyl)-6,6-dimethylpiperidin-3-one
CID 117020960
1-(2-methoxy-5-methylphenyl)-5,5-dimethylpyrrolidine-3-carboxylic acid
CID 117018427
1-(2,4-dimethoxyphenyl)-N,2,2-trimethylpyrrolidin-3-amine
CID 117017135
1-(3,4-dimethylphenyl)-N,5,5-trimethylpyrrolidin-3-amine
CID 117018211
7-methoxy-N,1-dimethyl-3,4-dihydro-2H-quinolin-3-amine
CID 83833452
2-[[1-(2,5-dimethoxyphenyl)pyrrolidin-3-yl]amino]acetonitrile
CID 117004681
6-(2,5-dimethoxyphenyl)-4a,5,7,7a-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,4-dione
CID 23052978
(1R,2R,6R,7R)-4-(2,5-dimethoxyphenyl)spiro[4-azatricyclo[5.2.1.02,6]dec-8-ene-10,1'-cyclopropane]-3,5-dione
CID 98762580
6-methoxy-N,1-dimethyl-3,4-dihydro-2H-quinolin-3-amine
CID 83833453

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dimethoxyphenyl)-N,5,5-trimethylpyrrolidin-3-amine?
The IUPAC name of 1-(2,5-dimethoxyphenyl)-N,5,5-trimethylpyrrolidin-3-amine (CID 117018248) is 1-(2,5-dimethoxyphenyl)-N,5,5-trimethylpyrrolidin-3-amine.
What is the SMILES notation for 1-(2,5-dimethoxyphenyl)-N,5,5-trimethylpyrrolidin-3-amine?
The canonical SMILES for 1-(2,5-dimethoxyphenyl)-N,5,5-trimethylpyrrolidin-3-amine is CNC1CN(c2cc(OC)ccc2OC)C(C)(C)C1.
What is the InChIKey of 1-(2,5-dimethoxyphenyl)-N,5,5-trimethylpyrrolidin-3-amine?
The InChIKey is IAPULZBVAHIFPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-15(2)9-11(16-3)10-17(15)13-8-12(18-4)6-7-14(13)19-5/h6-8,11,16H,9-10H2,1-5H3.
What are the key properties of 1-(2,5-dimethoxyphenyl)-N,5,5-trimethylpyrrolidin-3-amine?
1-(2,5-dimethoxyphenyl)-N,5,5-trimethylpyrrolidin-3-amine has a molecular weight of 264.37 g/mol, XLogP of 2.28, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dimethoxyphenyl)-N,5,5-trimethylpyrrolidin-3-amine is sourced from PubChem (CID 117018248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).