2-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]ethanamine

C10H21NO — CID 86775227

IUPAC2-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]ethanamine
SMILESCC(C)(C)OC1CC(CCN)C1
InChIInChI=1S/C10H21NO/c1-10(2,3)12-9-6-8(7-9)4-5-11/h8-9H,4-7,11H2,1-3H3
InChIKeyQNYQPLFDDKFUCH-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.93
Rot. Bonds3

About 2-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]ethanamine

2-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]ethanamine (PubChem CID 86775227) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 2-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]ethanamine.

Molecular Properties

Compound Name2-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]ethanamine
PubChem CID86775227
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name2-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]ethanamine
SMILESCC(C)(C)OC1CC(CCN)C1
InChIInChI=1S/C10H21NO/c1-10(2,3)12-9-6-8(7-9)4-5-11/h8-9H,4-7,11H2,1-3H3
InChIKeyQNYQPLFDDKFUCH-UHFFFAOYSA-N
XLogP1.93
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]ethanamine?
The IUPAC name of 2-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]ethanamine (CID 86775227) is 2-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]ethanamine.
What is the SMILES notation for 2-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]ethanamine?
The canonical SMILES for 2-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]ethanamine is CC(C)(C)OC1CC(CCN)C1.
What is the InChIKey of 2-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]ethanamine?
The InChIKey is QNYQPLFDDKFUCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-10(2,3)12-9-6-8(7-9)4-5-11/h8-9H,4-7,11H2,1-3H3.
What are the key properties of 2-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]ethanamine?
2-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]ethanamine has a molecular weight of 171.28 g/mol, XLogP of 1.93, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]ethanamine is sourced from PubChem (CID 86775227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).