1-methoxy-3-[methyl(2,2,2-trifluoroethyl)amino]propan-2-ol

C7H14F3NO2 — CID 62015935

IUPAC1-methoxy-3-[methyl(2,2,2-trifluoroethyl)amino]propan-2-ol
SMILESCOCC(O)CN(C)CC(F)(F)F
InChIInChI=1S/C7H14F3NO2/c1-11(5-7(8,9)10)3-6(12)4-13-2/h6,12H,3-5H2,1-2H3
InChIKeyGMSJYSXDXZRYKN-UHFFFAOYSA-N
MW201.19 g/mol
LogP0.49
Rot. Bonds5

About 1-methoxy-3-[methyl(2,2,2-trifluoroethyl)amino]propan-2-ol

1-methoxy-3-[methyl(2,2,2-trifluoroethyl)amino]propan-2-ol (PubChem CID 62015935) has the molecular formula C7H14F3NO2 and a molecular weight of 201.19 g/mol. Its IUPAC name is 1-methoxy-3-[methyl(2,2,2-trifluoroethyl)amino]propan-2-ol.

Molecular Properties

Compound Name1-methoxy-3-[methyl(2,2,2-trifluoroethyl)amino]propan-2-ol
PubChem CID62015935
Molecular FormulaC7H14F3NO2
Molecular Weight201.19 g/mol
Exact Mass201.10
IUPAC Name1-methoxy-3-[methyl(2,2,2-trifluoroethyl)amino]propan-2-ol
SMILESCOCC(O)CN(C)CC(F)(F)F
InChIInChI=1S/C7H14F3NO2/c1-11(5-7(8,9)10)3-6(12)4-13-2/h6,12H,3-5H2,1-2H3
InChIKeyGMSJYSXDXZRYKN-UHFFFAOYSA-N
XLogP0.49
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.19
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-methoxypropan-2-yloxy)-3-[methyl(2,2,2-trifluoroethyl)amino]propan-2-ol
CID 106991777
1-[[2-(aminomethyl)-2-methylbutyl]-methylamino]-3-methoxypropan-2-ol
CID 62270239
(2R)-1-[methyl(2,2,2-trifluoroethyl)amino]-3-phenylmethoxypropan-2-ol
CID 95356220
1-[3-fluoropropyl(methyl)amino]-3-methoxypropan-2-ol
CID 81113554
1-[3-(dimethylamino)propyl-methylamino]-3-methoxypropan-2-ol
CID 63928362
2-hydroxy-1-methoxy-3-[methyl(2,2,2-trifluoroethylsulfamoyl)amino]propane
CID 114809415
3,3,3-trifluoro-N-(2-hydroxy-3-methoxypropyl)-N-methyl-2-(trifluoromethyl)propanamide
CID 103310159
1-[2,2-difluoroethyl(methyl)amino]-3-(1-methoxypropan-2-yloxy)propan-2-ol
CID 106992238
1-[2-ethoxyethyl(methyl)amino]-3-methoxypropan-2-ol
CID 62013826
1-[[2-[(cyclopropylamino)methyl]-2-ethylbutyl]-methylamino]-3-methoxypropan-2-ol
CID 62270951
1-methoxy-3-[methyl(2-methylidenebutyl)amino]propan-2-ol
CID 66038780
1-methoxy-3-[methyl-[[2-(trifluoromethoxy)phenyl]methyl]amino]propan-2-ol
CID 111118115

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-3-[methyl(2,2,2-trifluoroethyl)amino]propan-2-ol?
The IUPAC name of 1-methoxy-3-[methyl(2,2,2-trifluoroethyl)amino]propan-2-ol (CID 62015935) is 1-methoxy-3-[methyl(2,2,2-trifluoroethyl)amino]propan-2-ol.
What is the SMILES notation for 1-methoxy-3-[methyl(2,2,2-trifluoroethyl)amino]propan-2-ol?
The canonical SMILES for 1-methoxy-3-[methyl(2,2,2-trifluoroethyl)amino]propan-2-ol is COCC(O)CN(C)CC(F)(F)F.
What is the InChIKey of 1-methoxy-3-[methyl(2,2,2-trifluoroethyl)amino]propan-2-ol?
The InChIKey is GMSJYSXDXZRYKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14F3NO2/c1-11(5-7(8,9)10)3-6(12)4-13-2/h6,12H,3-5H2,1-2H3.
What are the key properties of 1-methoxy-3-[methyl(2,2,2-trifluoroethyl)amino]propan-2-ol?
1-methoxy-3-[methyl(2,2,2-trifluoroethyl)amino]propan-2-ol has a molecular weight of 201.19 g/mol, XLogP of 0.49, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-3-[methyl(2,2,2-trifluoroethyl)amino]propan-2-ol is sourced from PubChem (CID 62015935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).