N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine;hydrochloride

C11H25ClN2O — CID 119923511

IUPACN-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine;hydrochloride
SMILESCNC1CCN(CCOC(C)C)CC1.Cl
InChIInChI=1S/C11H24N2O.ClH/c1-10(2)14-9-8-13-6-4-11(12-3)5-7-13;/h10-12H,4-9H2,1-3H3;1H
InChIKeyMIKOEVPSDIVFCJ-UHFFFAOYSA-N
MW236.79 g/mol
LogP1.52
Rot. Bonds5

About N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine;hydrochloride

N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine;hydrochloride (PubChem CID 119923511) has the molecular formula C11H25ClN2O and a molecular weight of 236.79 g/mol. Its IUPAC name is N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine;hydrochloride.

Molecular Properties

Compound NameN-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine;hydrochloride
PubChem CID119923511
Molecular FormulaC11H25ClN2O
Molecular Weight236.79 g/mol
Exact Mass236.17
IUPAC NameN-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine;hydrochloride
SMILESCNC1CCN(CCOC(C)C)CC1.Cl
InChIInChI=1S/C11H24N2O.ClH/c1-10(2)14-9-8-13-6-4-11(12-3)5-7-13;/h10-12H,4-9H2,1-3H3;1H
InChIKeyMIKOEVPSDIVFCJ-UHFFFAOYSA-N
XLogP1.52
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.79
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine;hydrochloride?
The IUPAC name of N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine;hydrochloride (CID 119923511) is N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine;hydrochloride.
What is the SMILES notation for N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine;hydrochloride?
The canonical SMILES for N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine;hydrochloride is CNC1CCN(CCOC(C)C)CC1.Cl.
What is the InChIKey of N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine;hydrochloride?
The InChIKey is MIKOEVPSDIVFCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O.ClH/c1-10(2)14-9-8-13-6-4-11(12-3)5-7-13;/h10-12H,4-9H2,1-3H3;1H.
What are the key properties of N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine;hydrochloride?
N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine;hydrochloride has a molecular weight of 236.79 g/mol, XLogP of 1.52, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine;hydrochloride is sourced from PubChem (CID 119923511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).