(2R)-1-[(2-methylpropan-2-yl)oxy]propan-2-amine

C7H17NO — CID 28998053

IUPAC(2R)-1-[(2-methylpropan-2-yl)oxy]propan-2-amine
SMILESC[C@@H](N)COC(C)(C)C
InChIInChI=1S/C7H17NO/c1-6(8)5-9-7(2,3)4/h6H,5,8H2,1-4H3/t6-/m1/s1
InChIKeyQOTBCSKXQXCOTD-ZCFIWIBFSA-N
MW131.22 g/mol
LogP1.15
Rot. Bonds2

About (2R)-1-[(2-methylpropan-2-yl)oxy]propan-2-amine

(2R)-1-[(2-methylpropan-2-yl)oxy]propan-2-amine (PubChem CID 28998053) has the molecular formula C7H17NO and a molecular weight of 131.22 g/mol. Its IUPAC name is (2R)-1-[(2-methylpropan-2-yl)oxy]propan-2-amine.

Molecular Properties

Compound Name(2R)-1-[(2-methylpropan-2-yl)oxy]propan-2-amine
PubChem CID28998053
Molecular FormulaC7H17NO
Molecular Weight131.22 g/mol
Exact Mass131.13
IUPAC Name(2R)-1-[(2-methylpropan-2-yl)oxy]propan-2-amine
SMILESC[C@@H](N)COC(C)(C)C
InChIInChI=1S/C7H17NO/c1-6(8)5-9-7(2,3)4/h6H,5,8H2,1-4H3/t6-/m1/s1
InChIKeyQOTBCSKXQXCOTD-ZCFIWIBFSA-N
XLogP1.15
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.22
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-1-[(2-methylpropan-2-yl)oxy]propan-2-amine?
The IUPAC name of (2R)-1-[(2-methylpropan-2-yl)oxy]propan-2-amine (CID 28998053) is (2R)-1-[(2-methylpropan-2-yl)oxy]propan-2-amine.
What is the SMILES notation for (2R)-1-[(2-methylpropan-2-yl)oxy]propan-2-amine?
The canonical SMILES for (2R)-1-[(2-methylpropan-2-yl)oxy]propan-2-amine is C[C@@H](N)COC(C)(C)C.
What is the InChIKey of (2R)-1-[(2-methylpropan-2-yl)oxy]propan-2-amine?
The InChIKey is QOTBCSKXQXCOTD-ZCFIWIBFSA-N. The full InChI is InChI=1S/C7H17NO/c1-6(8)5-9-7(2,3)4/h6H,5,8H2,1-4H3/t6-/m1/s1.
What are the key properties of (2R)-1-[(2-methylpropan-2-yl)oxy]propan-2-amine?
(2R)-1-[(2-methylpropan-2-yl)oxy]propan-2-amine has a molecular weight of 131.22 g/mol, XLogP of 1.15, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[(2-methylpropan-2-yl)oxy]propan-2-amine is sourced from PubChem (CID 28998053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).