3,3,3-trifluoro-2-(2-methylbutan-2-yloxy)propan-1-amine

C8H16F3NO — CID 43752961

IUPAC3,3,3-trifluoro-2-(2-methylbutan-2-yloxy)propan-1-amine
SMILESCCC(C)(C)OC(CN)C(F)(F)F
InChIInChI=1S/C8H16F3NO/c1-4-7(2,3)13-6(5-12)8(9,10)11/h6H,4-5,12H2,1-3H3
InChIKeyGECSRIVAZOFNBB-UHFFFAOYSA-N
MW199.22 g/mol
LogP2.08
Rot. Bonds4

About 3,3,3-trifluoro-2-(2-methylbutan-2-yloxy)propan-1-amine

3,3,3-trifluoro-2-(2-methylbutan-2-yloxy)propan-1-amine (PubChem CID 43752961) has the molecular formula C8H16F3NO and a molecular weight of 199.22 g/mol. Its IUPAC name is 3,3,3-trifluoro-2-(2-methylbutan-2-yloxy)propan-1-amine.

Molecular Properties

Compound Name3,3,3-trifluoro-2-(2-methylbutan-2-yloxy)propan-1-amine
PubChem CID43752961
Molecular FormulaC8H16F3NO
Molecular Weight199.22 g/mol
Exact Mass199.12
IUPAC Name3,3,3-trifluoro-2-(2-methylbutan-2-yloxy)propan-1-amine
SMILESCCC(C)(C)OC(CN)C(F)(F)F
InChIInChI=1S/C8H16F3NO/c1-4-7(2,3)13-6(5-12)8(9,10)11/h6H,4-5,12H2,1-3H3
InChIKeyGECSRIVAZOFNBB-UHFFFAOYSA-N
XLogP2.08
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.22
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-Ethoxy-3,3,3-trifluoropropan-1-amine
CID 43752850
2-(1,1,1,3,3,3-Hexafluoro-2-methylpropan-2-yl)oxyethanamine
CID 57917205
2-(2,2-Difluoroethoxy)propan-1-amine
CID 58684022
2-(2,2,2-Trifluoroethoxy)propan-1-amine
CID 58684937
2-Methyl-2-(2,2,2-trifluoroethoxy)propan-1-amine
CID 62355407
(2S)-2-ethoxy-3,3,3-trifluoropropan-1-amine
CID 88916802
2-(3-Fluoro-3-methylbutoxy)-2-methylpropan-1-amine
CID 89230242
2-(4,4-Difluoropentoxy)-2-methylpropan-1-amine
CID 91414179
2-[1-(4-Fluoro-2-methylbutan-2-yl)oxy-2-methylpropan-2-yl]oxyethanamine
CID 142483299
2-(4,4-Difluoropentoxy)-2-methylpropan-1-amine;ethane
CID 144089213
3,3-Difluoro-1-[(2-methylpropan-2-yl)oxy]butan-2-amine
CID 170585004
N-tert-butylsulfanyl-2-(1,1,1-trifluoro-2-methylpropan-2-yl)oxyethanamine
CID 172270425

Frequently Asked Questions

What is the IUPAC name of 3,3,3-trifluoro-2-(2-methylbutan-2-yloxy)propan-1-amine?
The IUPAC name of 3,3,3-trifluoro-2-(2-methylbutan-2-yloxy)propan-1-amine (CID 43752961) is 3,3,3-trifluoro-2-(2-methylbutan-2-yloxy)propan-1-amine.
What is the SMILES notation for 3,3,3-trifluoro-2-(2-methylbutan-2-yloxy)propan-1-amine?
The canonical SMILES for 3,3,3-trifluoro-2-(2-methylbutan-2-yloxy)propan-1-amine is CCC(C)(C)OC(CN)C(F)(F)F.
What is the InChIKey of 3,3,3-trifluoro-2-(2-methylbutan-2-yloxy)propan-1-amine?
The InChIKey is GECSRIVAZOFNBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16F3NO/c1-4-7(2,3)13-6(5-12)8(9,10)11/h6H,4-5,12H2,1-3H3.
What are the key properties of 3,3,3-trifluoro-2-(2-methylbutan-2-yloxy)propan-1-amine?
3,3,3-trifluoro-2-(2-methylbutan-2-yloxy)propan-1-amine has a molecular weight of 199.22 g/mol, XLogP of 2.08, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,3-trifluoro-2-(2-methylbutan-2-yloxy)propan-1-amine is sourced from PubChem (CID 43752961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).