2-(3,4-dimethoxyphenyl)-2-[1-(2-methylpropyl)piperidin-2-yl]ethanamine

C19H32N2O2 — CID 83986310

IUPAC2-(3,4-dimethoxyphenyl)-2-[1-(2-methylpropyl)piperidin-2-yl]ethanamine
SMILESCOc1ccc(C(CN)C2CCCCN2CC(C)C)cc1OC
InChIInChI=1S/C19H32N2O2/c1-14(2)13-21-10-6-5-7-17(21)16(12-20)15-8-9-18(22-3)19(11-15)23-4/h8-9,11,14,16-17H,5-7,10,12-13,20H2,1-4H3
InChIKeyMMYCFWURKIZKNN-UHFFFAOYSA-N
MW320.48 g/mol
LogP3.26
Rot. Bonds7

About 2-(3,4-dimethoxyphenyl)-2-[1-(2-methylpropyl)piperidin-2-yl]ethanamine

2-(3,4-dimethoxyphenyl)-2-[1-(2-methylpropyl)piperidin-2-yl]ethanamine (PubChem CID 83986310) has the molecular formula C19H32N2O2 and a molecular weight of 320.48 g/mol. Its IUPAC name is 2-(3,4-dimethoxyphenyl)-2-[1-(2-methylpropyl)piperidin-2-yl]ethanamine.

Molecular Properties

Compound Name2-(3,4-dimethoxyphenyl)-2-[1-(2-methylpropyl)piperidin-2-yl]ethanamine
PubChem CID83986310
Molecular FormulaC19H32N2O2
Molecular Weight320.48 g/mol
Exact Mass320.25
IUPAC Name2-(3,4-dimethoxyphenyl)-2-[1-(2-methylpropyl)piperidin-2-yl]ethanamine
SMILESCOc1ccc(C(CN)C2CCCCN2CC(C)C)cc1OC
InChIInChI=1S/C19H32N2O2/c1-14(2)13-21-10-6-5-7-17(21)16(12-20)15-8-9-18(22-3)19(11-15)23-4/h8-9,11,14,16-17H,5-7,10,12-13,20H2,1-4H3
InChIKeyMMYCFWURKIZKNN-UHFFFAOYSA-N
XLogP3.26
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.48
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(3,4-dimethoxyphenyl)-2-[1-(2-methylpropyl)piperidin-2-yl]ethanamine 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

2-(3,4-difluorophenyl)-2-[1-(2-methylpropyl)piperidin-2-yl]ethanamine
CID 83986706
4-[2-amino-1-[1-(2-methylpropyl)piperidin-2-yl]ethyl]phenol
CID 83987245
2-(4-methoxy-3-methylphenyl)-2-(1-methylpiperidin-2-yl)ethanamine
CID 83986819
(2R)-2-(azepan-1-yl)-2-(3,4-dimethoxyphenyl)ethanamine
CID 9161144
2-(3,4-difluorophenyl)-2-(1-propylpiperidin-2-yl)ethanamine
CID 83986705
2-(5-fluoro-2-methoxyphenyl)-2-(1-propylpiperidin-2-yl)ethanamine
CID 83987062
2-(3,4-dichlorophenyl)-2-(1-propylpiperidin-2-yl)ethanamine
CID 83986396
2-(1,3-benzodioxol-5-yl)-2-(1-ethylpiperidin-2-yl)ethanamine
CID 83986798
2-(5-chloro-1H-indol-3-yl)-2-[1-(2-methylpropyl)piperidin-2-yl]ethanamine
CID 83987539
(4-methoxyphenyl)-[(2R)-1-(2-methylpropyl)pyrrolidin-2-yl]methanol
CID 101213323
2-(3,4-dimethoxyphenyl)-2-(2-methylpyrrolidin-1-yl)ethanamine
CID 54882022
2-cyclopropyl-1-(3,4-dimethoxyphenyl)propan-1-amine
CID 83155157

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethoxyphenyl)-2-[1-(2-methylpropyl)piperidin-2-yl]ethanamine?
The IUPAC name of 2-(3,4-dimethoxyphenyl)-2-[1-(2-methylpropyl)piperidin-2-yl]ethanamine (CID 83986310) is 2-(3,4-dimethoxyphenyl)-2-[1-(2-methylpropyl)piperidin-2-yl]ethanamine.
What is the SMILES notation for 2-(3,4-dimethoxyphenyl)-2-[1-(2-methylpropyl)piperidin-2-yl]ethanamine?
The canonical SMILES for 2-(3,4-dimethoxyphenyl)-2-[1-(2-methylpropyl)piperidin-2-yl]ethanamine is COc1ccc(C(CN)C2CCCCN2CC(C)C)cc1OC.
What is the InChIKey of 2-(3,4-dimethoxyphenyl)-2-[1-(2-methylpropyl)piperidin-2-yl]ethanamine?
The InChIKey is MMYCFWURKIZKNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N2O2/c1-14(2)13-21-10-6-5-7-17(21)16(12-20)15-8-9-18(22-3)19(11-15)23-4/h8-9,11,14,16-17H,5-7,10,12-13,20H2,1-4H3.
What are the key properties of 2-(3,4-dimethoxyphenyl)-2-[1-(2-methylpropyl)piperidin-2-yl]ethanamine?
2-(3,4-dimethoxyphenyl)-2-[1-(2-methylpropyl)piperidin-2-yl]ethanamine has a molecular weight of 320.48 g/mol, XLogP of 3.26, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethoxyphenyl)-2-[1-(2-methylpropyl)piperidin-2-yl]ethanamine is sourced from PubChem (CID 83986310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).