1-(ethylamino)-3-(2,2,2-trifluoroethoxy)propan-2-ol

C7H14F3NO2 — CID 43166141

IUPAC1-(ethylamino)-3-(2,2,2-trifluoroethoxy)propan-2-ol
SMILESCCNCC(O)COCC(F)(F)F
InChIInChI=1S/C7H14F3NO2/c1-2-11-3-6(12)4-13-5-7(8,9)10/h6,11-12H,2-5H2,1H3
InChIKeyDQVRIGOOLBCJKM-UHFFFAOYSA-N
MW201.19 g/mol
LogP0.54
Rot. Bonds6

About 1-(ethylamino)-3-(2,2,2-trifluoroethoxy)propan-2-ol

1-(ethylamino)-3-(2,2,2-trifluoroethoxy)propan-2-ol (PubChem CID 43166141) has the molecular formula C7H14F3NO2 and a molecular weight of 201.19 g/mol. Its IUPAC name is 1-(ethylamino)-3-(2,2,2-trifluoroethoxy)propan-2-ol.

Molecular Properties

Compound Name1-(ethylamino)-3-(2,2,2-trifluoroethoxy)propan-2-ol
PubChem CID43166141
Molecular FormulaC7H14F3NO2
Molecular Weight201.19 g/mol
Exact Mass201.10
IUPAC Name1-(ethylamino)-3-(2,2,2-trifluoroethoxy)propan-2-ol
SMILESCCNCC(O)COCC(F)(F)F
InChIInChI=1S/C7H14F3NO2/c1-2-11-3-6(12)4-13-5-7(8,9)10/h6,11-12H,2-5H2,1H3
InChIKeyDQVRIGOOLBCJKM-UHFFFAOYSA-N
XLogP0.54
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.19
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-ethylphenyl)-3-(2,2,2-trifluoroethoxy)propan-2-ol
CID 103216652
1-ethoxy-3-[(3-ethoxy-2-hydroxypropyl)amino]propan-2-ol
CID 139812156
1-(ethylamino)-3-fluoropropan-2-ol
CID 59154890
5,5-dimethyl-1-(2,2,2-trifluoroethoxy)hexan-2-ol
CID 103216774
1-(2-methoxyethoxy)-3-(3,3,3-trifluoropropylamino)propan-2-ol
CID 106989915
1-[(2-methylpropan-2-yl)oxy]-3-(2,2,2-trifluoroethoxyamino)propan-2-ol
CID 82722599
2-methyl-3-(2,2,2-trifluoroethoxy)-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 106706230
4,4-dimethyl-1-[3-(2,2,2-trifluoroethoxy)propylamino]pentan-2-ol
CID 107152188
3-methyl-1-(2,2,2-trifluoroethoxy)hexan-2-ol
CID 107893094
1-[[2-hydroxy-3-(2-methoxyethoxy)propyl]amino]butan-2-ol
CID 106990539
1-ethoxy-3-(propylamino)propan-2-ol
CID 15683481
3-[[(3-ethoxy-2-hydroxypropyl)amino]methyl]pentan-3-ol
CID 65111279

Frequently Asked Questions

What is the IUPAC name of 1-(ethylamino)-3-(2,2,2-trifluoroethoxy)propan-2-ol?
The IUPAC name of 1-(ethylamino)-3-(2,2,2-trifluoroethoxy)propan-2-ol (CID 43166141) is 1-(ethylamino)-3-(2,2,2-trifluoroethoxy)propan-2-ol.
What is the SMILES notation for 1-(ethylamino)-3-(2,2,2-trifluoroethoxy)propan-2-ol?
The canonical SMILES for 1-(ethylamino)-3-(2,2,2-trifluoroethoxy)propan-2-ol is CCNCC(O)COCC(F)(F)F.
What is the InChIKey of 1-(ethylamino)-3-(2,2,2-trifluoroethoxy)propan-2-ol?
The InChIKey is DQVRIGOOLBCJKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14F3NO2/c1-2-11-3-6(12)4-13-5-7(8,9)10/h6,11-12H,2-5H2,1H3.
What are the key properties of 1-(ethylamino)-3-(2,2,2-trifluoroethoxy)propan-2-ol?
1-(ethylamino)-3-(2,2,2-trifluoroethoxy)propan-2-ol has a molecular weight of 201.19 g/mol, XLogP of 0.54, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(ethylamino)-3-(2,2,2-trifluoroethoxy)propan-2-ol is sourced from PubChem (CID 43166141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).