1-(2-amino-2-methylpropoxy)-3-(1-methoxypropan-2-yloxy)propan-2-ol

C11H25NO4 — CID 106991230

IUPAC1-(2-amino-2-methylpropoxy)-3-(1-methoxypropan-2-yloxy)propan-2-ol
SMILESCOCC(C)OCC(O)COCC(C)(C)N
InChIInChI=1S/C11H25NO4/c1-9(5-14-4)16-7-10(13)6-15-8-11(2,3)12/h9-10,13H,5-8,12H2,1-4H3
InChIKeyGAZSINFMFFQOMV-UHFFFAOYSA-N
MW235.32 g/mol
LogP0.15
Rot. Bonds9

About 1-(2-amino-2-methylpropoxy)-3-(1-methoxypropan-2-yloxy)propan-2-ol

1-(2-amino-2-methylpropoxy)-3-(1-methoxypropan-2-yloxy)propan-2-ol (PubChem CID 106991230) has the molecular formula C11H25NO4 and a molecular weight of 235.32 g/mol. Its IUPAC name is 1-(2-amino-2-methylpropoxy)-3-(1-methoxypropan-2-yloxy)propan-2-ol.

Molecular Properties

Compound Name1-(2-amino-2-methylpropoxy)-3-(1-methoxypropan-2-yloxy)propan-2-ol
PubChem CID106991230
Molecular FormulaC11H25NO4
Molecular Weight235.32 g/mol
Exact Mass235.18
IUPAC Name1-(2-amino-2-methylpropoxy)-3-(1-methoxypropan-2-yloxy)propan-2-ol
SMILESCOCC(C)OCC(O)COCC(C)(C)N
InChIInChI=1S/C11H25NO4/c1-9(5-14-4)16-7-10(13)6-15-8-11(2,3)12/h9-10,13H,5-8,12H2,1-4H3
InChIKeyGAZSINFMFFQOMV-UHFFFAOYSA-N
XLogP0.15
TPSA73.94 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.32
LogP ≤ 50.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-methoxy-3-(1-methoxypropan-2-yloxy)propan-2-ol
CID 107508429
1-(2-amino-2-methylpropoxy)-3-ethoxypropan-2-ol
CID 106939938
1-(2-amino-2-methylpropoxy)butan-2-ol
CID 106939915
1-[1-[1-(1-methoxypropan-2-yloxy)propan-2-yloxy]propan-2-yloxy]butan-2-ol
CID 20834285
1-(1-methoxypropan-2-yloxy)-7-methyloctane-2,5-diol
CID 106992842
1-[3-(aminomethyl)pentan-3-yloxy]-3-(1-methoxypropan-2-yloxy)propan-2-ol
CID 106988251
4-hydroxy-5-(1-methoxypropan-2-yloxy)-2,2-dimethylpentanoic acid
CID 106991570
1-[[2-hydroxy-3-(1-methoxypropan-2-yloxy)propyl]amino]-4,4-dimethylpentan-2-ol
CID 107151910
1-azido-3-(1-methoxypropan-2-yloxy)propan-2-ol
CID 106991332
1-(1-methoxypropan-2-yloxy)-3-(piperidin-4-ylmethoxy)propan-2-ol
CID 106991203
1-(1-methoxypropan-2-yloxy)-3-(2,4,4-trimethylpentan-2-ylamino)propan-2-ol
CID 106989714
1-amino-3-(1-methoxypropan-2-yloxy)-2-methylpropan-2-ol
CID 64821675

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-2-methylpropoxy)-3-(1-methoxypropan-2-yloxy)propan-2-ol?
The IUPAC name of 1-(2-amino-2-methylpropoxy)-3-(1-methoxypropan-2-yloxy)propan-2-ol (CID 106991230) is 1-(2-amino-2-methylpropoxy)-3-(1-methoxypropan-2-yloxy)propan-2-ol.
What is the SMILES notation for 1-(2-amino-2-methylpropoxy)-3-(1-methoxypropan-2-yloxy)propan-2-ol?
The canonical SMILES for 1-(2-amino-2-methylpropoxy)-3-(1-methoxypropan-2-yloxy)propan-2-ol is COCC(C)OCC(O)COCC(C)(C)N.
What is the InChIKey of 1-(2-amino-2-methylpropoxy)-3-(1-methoxypropan-2-yloxy)propan-2-ol?
The InChIKey is GAZSINFMFFQOMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO4/c1-9(5-14-4)16-7-10(13)6-15-8-11(2,3)12/h9-10,13H,5-8,12H2,1-4H3.
What are the key properties of 1-(2-amino-2-methylpropoxy)-3-(1-methoxypropan-2-yloxy)propan-2-ol?
1-(2-amino-2-methylpropoxy)-3-(1-methoxypropan-2-yloxy)propan-2-ol has a molecular weight of 235.32 g/mol, XLogP of 0.15, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-2-methylpropoxy)-3-(1-methoxypropan-2-yloxy)propan-2-ol is sourced from PubChem (CID 106991230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).