3-methoxy-2-methyl-2-(4-propan-2-ylpiperidin-1-yl)propan-1-amine

C13H28N2O — CID 103494738

IUPAC3-methoxy-2-methyl-2-(4-propan-2-ylpiperidin-1-yl)propan-1-amine
SMILESCOCC(C)(CN)N1CCC(C(C)C)CC1
InChIInChI=1S/C13H28N2O/c1-11(2)12-5-7-15(8-6-12)13(3,9-14)10-16-4/h11-12H,5-10,14H2,1-4H3
InChIKeyGESXIHRNMITYLS-UHFFFAOYSA-N
MW228.38 g/mol
LogP1.72
Rot. Bonds5

About 3-methoxy-2-methyl-2-(4-propan-2-ylpiperidin-1-yl)propan-1-amine

3-methoxy-2-methyl-2-(4-propan-2-ylpiperidin-1-yl)propan-1-amine (PubChem CID 103494738) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is 3-methoxy-2-methyl-2-(4-propan-2-ylpiperidin-1-yl)propan-1-amine.

Molecular Properties

Compound Name3-methoxy-2-methyl-2-(4-propan-2-ylpiperidin-1-yl)propan-1-amine
PubChem CID103494738
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC Name3-methoxy-2-methyl-2-(4-propan-2-ylpiperidin-1-yl)propan-1-amine
SMILESCOCC(C)(CN)N1CCC(C(C)C)CC1
InChIInChI=1S/C13H28N2O/c1-11(2)12-5-7-15(8-6-12)13(3,9-14)10-16-4/h11-12H,5-10,14H2,1-4H3
InChIKeyGESXIHRNMITYLS-UHFFFAOYSA-N
XLogP1.72
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-methoxy-2-methyl-2-(4-propan-2-ylpiperidin-1-yl)propan-1-amine 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

3-methoxy-2-(4-methoxypiperidin-1-yl)-2-methylpropan-1-amine
CID 62534739
3-methoxy-2-methyl-2-(4-methylpiperazin-1-yl)propan-1-amine
CID 62534542
2-methyl-2-(4-propan-2-ylpiperidin-1-yl)nonan-1-amine
CID 103494824
3-methoxy-2-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-amine
CID 63169633
3-methoxy-2-methyl-2-(4-methylsulfonylpiperazin-1-yl)propan-1-amine
CID 55133510
2-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)-3-methoxy-2-methylpropan-1-amine
CID 55166749
2-(2,6-dimethylmorpholin-4-yl)-3-methoxy-2-methylpropan-1-amine
CID 62534733
2-methyl-2-(4-methylpiperidin-1-yl)butan-1-amine
CID 24689599
3-methoxy-2-methyl-2-(2-methylpiperidin-1-yl)propan-1-amine
CID 62534541
3-methoxy-2-methyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-amine
CID 62535879
4-methoxy-4-methyl-2-(4-propan-2-ylpiperidin-1-yl)pentan-1-amine
CID 106675843
2-methoxy-3-(4-propan-2-ylpiperidin-1-yl)propan-1-amine
CID 106115086

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-methyl-2-(4-propan-2-ylpiperidin-1-yl)propan-1-amine?
The IUPAC name of 3-methoxy-2-methyl-2-(4-propan-2-ylpiperidin-1-yl)propan-1-amine (CID 103494738) is 3-methoxy-2-methyl-2-(4-propan-2-ylpiperidin-1-yl)propan-1-amine.
What is the SMILES notation for 3-methoxy-2-methyl-2-(4-propan-2-ylpiperidin-1-yl)propan-1-amine?
The canonical SMILES for 3-methoxy-2-methyl-2-(4-propan-2-ylpiperidin-1-yl)propan-1-amine is COCC(C)(CN)N1CCC(C(C)C)CC1.
What is the InChIKey of 3-methoxy-2-methyl-2-(4-propan-2-ylpiperidin-1-yl)propan-1-amine?
The InChIKey is GESXIHRNMITYLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-11(2)12-5-7-15(8-6-12)13(3,9-14)10-16-4/h11-12H,5-10,14H2,1-4H3.
What are the key properties of 3-methoxy-2-methyl-2-(4-propan-2-ylpiperidin-1-yl)propan-1-amine?
3-methoxy-2-methyl-2-(4-propan-2-ylpiperidin-1-yl)propan-1-amine has a molecular weight of 228.38 g/mol, XLogP of 1.72, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-methyl-2-(4-propan-2-ylpiperidin-1-yl)propan-1-amine is sourced from PubChem (CID 103494738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).