2-(ethylamino)-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-methylbutan-1-ol

C10H17F6NO2 — CID 102723478

IUPAC2-(ethylamino)-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-methylbutan-1-ol
SMILESCCNC(C)(CO)CCOC(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C10H17F6NO2/c1-3-17-8(2,6-18)4-5-19-7(9(11,12)13)10(14,15)16/h7,17-18H,3-6H2,1-2H3
InChIKeyWIVJEGSGIQFUHE-UHFFFAOYSA-N
MW297.24 g/mol
LogP2.25
Rot. Bonds7

About 2-(ethylamino)-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-methylbutan-1-ol

2-(ethylamino)-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-methylbutan-1-ol (PubChem CID 102723478) has the molecular formula C10H17F6NO2 and a molecular weight of 297.24 g/mol. Its IUPAC name is 2-(ethylamino)-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-methylbutan-1-ol.

Molecular Properties

Compound Name2-(ethylamino)-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-methylbutan-1-ol
PubChem CID102723478
Molecular FormulaC10H17F6NO2
Molecular Weight297.24 g/mol
Exact Mass297.12
IUPAC Name2-(ethylamino)-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-methylbutan-1-ol
SMILESCCNC(C)(CO)CCOC(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C10H17F6NO2/c1-3-17-8(2,6-18)4-5-19-7(9(11,12)13)10(14,15)16/h7,17-18H,3-6H2,1-2H3
InChIKeyWIVJEGSGIQFUHE-UHFFFAOYSA-N
XLogP2.25
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.24
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[1-[3-(Tert-butylamino)-1,1,1-trifluoropropan-2-yl]oxy-2-methylpropan-2-yl]amino]butan-2-ol
CID 134533548
3-[3-(Tert-butylamino)-2,2-difluoropropoxy]-2,2-difluoropropan-1-ol
CID 156047610
4-Methoxy-2,4-dimethyl-2-(2,2,2-trifluoroethylamino)pentan-1-ol
CID 61045657
2-[3-(2,2,2-Trifluoroethoxy)propylamino]butan-1-ol
CID 61491081
2-Methyl-2-[3-(2,2,2-trifluoroethoxy)propylamino]propan-1-ol
CID 61491122
4-Methoxy-2-methyl-2-(2,2,2-trifluoroethylamino)butan-1-ol
CID 61873000
2-Ethyl-2-[2-(2,2,2-trifluoroethoxy)ethylamino]butan-1-ol
CID 62517448
2-Ethyl-2-[3-(2,2,2-trifluoroethoxy)propylamino]butan-1-ol
CID 62517611
2-Ethyl-2-[(3,3,3-trifluoro-2-hydroxypropyl)amino]butan-1-ol
CID 63900668
1,1,1-Trifluoro-3-[2-(3-methylbutoxy)ethylamino]propan-2-ol
CID 63901692
2-(Methoxymethyl)-2-(2,2,2-trifluoroethylamino)butan-1-ol
CID 64395549
2-Methyl-2-[2-(2,2,2-trifluoroethoxy)ethylamino]butan-1-ol
CID 64458479

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-methylbutan-1-ol?
The IUPAC name of 2-(ethylamino)-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-methylbutan-1-ol (CID 102723478) is 2-(ethylamino)-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-methylbutan-1-ol.
What is the SMILES notation for 2-(ethylamino)-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-methylbutan-1-ol?
The canonical SMILES for 2-(ethylamino)-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-methylbutan-1-ol is CCNC(C)(CO)CCOC(C(F)(F)F)C(F)(F)F.
What is the InChIKey of 2-(ethylamino)-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-methylbutan-1-ol?
The InChIKey is WIVJEGSGIQFUHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F6NO2/c1-3-17-8(2,6-18)4-5-19-7(9(11,12)13)10(14,15)16/h7,17-18H,3-6H2,1-2H3.
What are the key properties of 2-(ethylamino)-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-methylbutan-1-ol?
2-(ethylamino)-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-methylbutan-1-ol has a molecular weight of 297.24 g/mol, XLogP of 2.25, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-methylbutan-1-ol is sourced from PubChem (CID 102723478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).