2-methyl-2-[1-(2-methylbutan-2-yloxy)propan-2-yloxy]propan-1-amine

C12H27NO2 — CID 155069965

IUPAC2-methyl-2-[1-(2-methylbutan-2-yloxy)propan-2-yloxy]propan-1-amine
SMILESCCC(C)(C)OCC(C)OC(C)(C)CN
InChIInChI=1S/C12H27NO2/c1-7-11(3,4)14-8-10(2)15-12(5,6)9-13/h10H,7-9,13H2,1-6H3
InChIKeyMBZAEUHUQMACQM-UHFFFAOYSA-N
MW217.35 g/mol
LogP2.33
Rot. Bonds7

About 2-methyl-2-[1-(2-methylbutan-2-yloxy)propan-2-yloxy]propan-1-amine

2-methyl-2-[1-(2-methylbutan-2-yloxy)propan-2-yloxy]propan-1-amine (PubChem CID 155069965) has the molecular formula C12H27NO2 and a molecular weight of 217.35 g/mol. Its IUPAC name is 2-methyl-2-[1-(2-methylbutan-2-yloxy)propan-2-yloxy]propan-1-amine.

Molecular Properties

Compound Name2-methyl-2-[1-(2-methylbutan-2-yloxy)propan-2-yloxy]propan-1-amine
PubChem CID155069965
Molecular FormulaC12H27NO2
Molecular Weight217.35 g/mol
Exact Mass217.20
IUPAC Name2-methyl-2-[1-(2-methylbutan-2-yloxy)propan-2-yloxy]propan-1-amine
SMILESCCC(C)(C)OCC(C)OC(C)(C)CN
InChIInChI=1S/C12H27NO2/c1-7-11(3,4)14-8-10(2)15-12(5,6)9-13/h10H,7-9,13H2,1-6H3
InChIKeyMBZAEUHUQMACQM-UHFFFAOYSA-N
XLogP2.33
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.35
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[1-(2-methylbutan-2-yloxy)propan-2-yloxy]propan-1-amine?
The IUPAC name of 2-methyl-2-[1-(2-methylbutan-2-yloxy)propan-2-yloxy]propan-1-amine (CID 155069965) is 2-methyl-2-[1-(2-methylbutan-2-yloxy)propan-2-yloxy]propan-1-amine.
What is the SMILES notation for 2-methyl-2-[1-(2-methylbutan-2-yloxy)propan-2-yloxy]propan-1-amine?
The canonical SMILES for 2-methyl-2-[1-(2-methylbutan-2-yloxy)propan-2-yloxy]propan-1-amine is CCC(C)(C)OCC(C)OC(C)(C)CN.
What is the InChIKey of 2-methyl-2-[1-(2-methylbutan-2-yloxy)propan-2-yloxy]propan-1-amine?
The InChIKey is MBZAEUHUQMACQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27NO2/c1-7-11(3,4)14-8-10(2)15-12(5,6)9-13/h10H,7-9,13H2,1-6H3.
What are the key properties of 2-methyl-2-[1-(2-methylbutan-2-yloxy)propan-2-yloxy]propan-1-amine?
2-methyl-2-[1-(2-methylbutan-2-yloxy)propan-2-yloxy]propan-1-amine has a molecular weight of 217.35 g/mol, XLogP of 2.33, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[1-(2-methylbutan-2-yloxy)propan-2-yloxy]propan-1-amine is sourced from PubChem (CID 155069965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).