2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-amine;hydrochloride

C8H20ClNO — CID 155821188

IUPAC2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-amine;hydrochloride
SMILESCC(C)(N)COC(C)(C)C.Cl
InChIInChI=1S/C8H19NO.ClH/c1-7(2,3)10-6-8(4,5)9;/h6,9H2,1-5H3;1H
InChIKeyHMXNWIKWTZFRJY-UHFFFAOYSA-N
MW181.71 g/mol
LogP1.96
Rot. Bonds2

About 2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-amine;hydrochloride

2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-amine;hydrochloride (PubChem CID 155821188) has the molecular formula C8H20ClNO and a molecular weight of 181.71 g/mol. Its IUPAC name is 2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-amine;hydrochloride.

Molecular Properties

Compound Name2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-amine;hydrochloride
PubChem CID155821188
Molecular FormulaC8H20ClNO
Molecular Weight181.71 g/mol
Exact Mass181.12
IUPAC Name2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-amine;hydrochloride
SMILESCC(C)(N)COC(C)(C)C.Cl
InChIInChI=1S/C8H19NO.ClH/c1-7(2,3)10-6-8(4,5)9;/h6,9H2,1-5H3;1H
InChIKeyHMXNWIKWTZFRJY-UHFFFAOYSA-N
XLogP1.96
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.71
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-amine;hydrochloride?
The IUPAC name of 2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-amine;hydrochloride (CID 155821188) is 2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-amine;hydrochloride.
What is the SMILES notation for 2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-amine;hydrochloride?
The canonical SMILES for 2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-amine;hydrochloride is CC(C)(N)COC(C)(C)C.Cl.
What is the InChIKey of 2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-amine;hydrochloride?
The InChIKey is HMXNWIKWTZFRJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO.ClH/c1-7(2,3)10-6-8(4,5)9;/h6,9H2,1-5H3;1H.
What are the key properties of 2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-amine;hydrochloride?
2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-amine;hydrochloride has a molecular weight of 181.71 g/mol, XLogP of 1.96, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-amine;hydrochloride is sourced from PubChem (CID 155821188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).