1-methyl-4-(2-propan-2-yloxyethoxy)piperidin-3-amine

C11H24N2O2 — CID 134434456

IUPAC1-methyl-4-(2-propan-2-yloxyethoxy)piperidin-3-amine
SMILESCC(C)OCCOC1CCN(C)CC1N
InChIInChI=1S/C11H24N2O2/c1-9(2)14-6-7-15-11-4-5-13(3)8-10(11)12/h9-11H,4-8,12H2,1-3H3
InChIKeyOCPPJICTHWNDCK-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.46
Rot. Bonds5

About 1-methyl-4-(2-propan-2-yloxyethoxy)piperidin-3-amine

1-methyl-4-(2-propan-2-yloxyethoxy)piperidin-3-amine (PubChem CID 134434456) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 1-methyl-4-(2-propan-2-yloxyethoxy)piperidin-3-amine.

Molecular Properties

Compound Name1-methyl-4-(2-propan-2-yloxyethoxy)piperidin-3-amine
PubChem CID134434456
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name1-methyl-4-(2-propan-2-yloxyethoxy)piperidin-3-amine
SMILESCC(C)OCCOC1CCN(C)CC1N
InChIInChI=1S/C11H24N2O2/c1-9(2)14-6-7-15-11-4-5-13(3)8-10(11)12/h9-11H,4-8,12H2,1-3H3
InChIKeyOCPPJICTHWNDCK-UHFFFAOYSA-N
XLogP0.46
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-(2-propan-2-yloxyethoxy)piperidin-3-amine?
The IUPAC name of 1-methyl-4-(2-propan-2-yloxyethoxy)piperidin-3-amine (CID 134434456) is 1-methyl-4-(2-propan-2-yloxyethoxy)piperidin-3-amine.
What is the SMILES notation for 1-methyl-4-(2-propan-2-yloxyethoxy)piperidin-3-amine?
The canonical SMILES for 1-methyl-4-(2-propan-2-yloxyethoxy)piperidin-3-amine is CC(C)OCCOC1CCN(C)CC1N.
What is the InChIKey of 1-methyl-4-(2-propan-2-yloxyethoxy)piperidin-3-amine?
The InChIKey is OCPPJICTHWNDCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-9(2)14-6-7-15-11-4-5-13(3)8-10(11)12/h9-11H,4-8,12H2,1-3H3.
What are the key properties of 1-methyl-4-(2-propan-2-yloxyethoxy)piperidin-3-amine?
1-methyl-4-(2-propan-2-yloxyethoxy)piperidin-3-amine has a molecular weight of 216.32 g/mol, XLogP of 0.46, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(2-propan-2-yloxyethoxy)piperidin-3-amine is sourced from PubChem (CID 134434456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).