2-(methoxymethyl)-2-(3-methoxypiperidin-1-yl)-3-methylbutan-1-amine

C13H28N2O2 — CID 102965095

IUPAC2-(methoxymethyl)-2-(3-methoxypiperidin-1-yl)-3-methylbutan-1-amine
SMILESCOCC(CN)(C(C)C)N1CCCC(OC)C1
InChIInChI=1S/C13H28N2O2/c1-11(2)13(9-14,10-16-3)15-7-5-6-12(8-15)17-4/h11-12H,5-10,14H2,1-4H3
InChIKeyXMQBHAMJXMFKKP-UHFFFAOYSA-N
MW244.38 g/mol
LogP1.10
Rot. Bonds6

About 2-(methoxymethyl)-2-(3-methoxypiperidin-1-yl)-3-methylbutan-1-amine

2-(methoxymethyl)-2-(3-methoxypiperidin-1-yl)-3-methylbutan-1-amine (PubChem CID 102965095) has the molecular formula C13H28N2O2 and a molecular weight of 244.38 g/mol. Its IUPAC name is 2-(methoxymethyl)-2-(3-methoxypiperidin-1-yl)-3-methylbutan-1-amine.

Molecular Properties

Compound Name2-(methoxymethyl)-2-(3-methoxypiperidin-1-yl)-3-methylbutan-1-amine
PubChem CID102965095
Molecular FormulaC13H28N2O2
Molecular Weight244.38 g/mol
Exact Mass244.22
IUPAC Name2-(methoxymethyl)-2-(3-methoxypiperidin-1-yl)-3-methylbutan-1-amine
SMILESCOCC(CN)(C(C)C)N1CCCC(OC)C1
InChIInChI=1S/C13H28N2O2/c1-11(2)13(9-14,10-16-3)15-7-5-6-12(8-15)17-4/h11-12H,5-10,14H2,1-4H3
InChIKeyXMQBHAMJXMFKKP-UHFFFAOYSA-N
XLogP1.10
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(methoxymethyl)-2-(3-methoxypiperidin-1-yl)-3-methylbutan-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-cyclopropyl-2-(3-methoxypiperidin-1-yl)-2-methylpropan-1-amine
CID 102965180
2,3-dimethyl-2-(3-propoxypiperidin-1-yl)butan-1-amine
CID 54985244
2-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)-2-(methoxymethyl)-3-methylbutan-1-amine
CID 82746702
2-cyclopropyl-3-methoxy-2-(3-methoxypyrrolidin-1-yl)propan-1-amine
CID 103531648
3-(3-methoxypiperidin-1-yl)-2-methylbutan-1-amine
CID 102968184
2-(7,7-dimethyl-1,4-thiazepan-4-yl)-2-(methoxymethyl)-3-methylbutan-1-amine
CID 107454301
2-amino-1-(3-methoxypiperidin-1-yl)ethanone
CID 66564450
5-(3-methoxypiperidin-1-yl)-4-methylpentan-1-amine
CID 102963876
2-methoxy-3-(3-methoxypiperidin-1-yl)propan-1-amine
CID 106115075
3-methoxy-2-(4-methoxypiperidin-1-yl)-2-methylpropan-1-amine
CID 62534739
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
4-methoxy-2-(3-methoxypyrrolidin-1-yl)-2-methylbutan-1-amine
CID 103531700

Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-2-(3-methoxypiperidin-1-yl)-3-methylbutan-1-amine?
The IUPAC name of 2-(methoxymethyl)-2-(3-methoxypiperidin-1-yl)-3-methylbutan-1-amine (CID 102965095) is 2-(methoxymethyl)-2-(3-methoxypiperidin-1-yl)-3-methylbutan-1-amine.
What is the SMILES notation for 2-(methoxymethyl)-2-(3-methoxypiperidin-1-yl)-3-methylbutan-1-amine?
The canonical SMILES for 2-(methoxymethyl)-2-(3-methoxypiperidin-1-yl)-3-methylbutan-1-amine is COCC(CN)(C(C)C)N1CCCC(OC)C1.
What is the InChIKey of 2-(methoxymethyl)-2-(3-methoxypiperidin-1-yl)-3-methylbutan-1-amine?
The InChIKey is XMQBHAMJXMFKKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O2/c1-11(2)13(9-14,10-16-3)15-7-5-6-12(8-15)17-4/h11-12H,5-10,14H2,1-4H3.
What are the key properties of 2-(methoxymethyl)-2-(3-methoxypiperidin-1-yl)-3-methylbutan-1-amine?
2-(methoxymethyl)-2-(3-methoxypiperidin-1-yl)-3-methylbutan-1-amine has a molecular weight of 244.38 g/mol, XLogP of 1.10, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-2-(3-methoxypiperidin-1-yl)-3-methylbutan-1-amine is sourced from PubChem (CID 102965095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).