2-methyl-N-[[2-methyl-3-(2,2,2-trifluoroethoxymethyl)oxolan-3-yl]methyl]propan-2-amine

C13H24F3NO2 — CID 106706226

IUPAC2-methyl-N-[[2-methyl-3-(2,2,2-trifluoroethoxymethyl)oxolan-3-yl]methyl]propan-2-amine
SMILESCC1OCCC1(CNC(C)(C)C)COCC(F)(F)F
InChIInChI=1S/C13H24F3NO2/c1-10-12(5-6-19-10,7-17-11(2,3)4)8-18-9-13(14,15)16/h10,17H,5-9H2,1-4H3
InChIKeyPRKWEYMFQVAEGP-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.75
Rot. Bonds5

About 2-methyl-N-[[2-methyl-3-(2,2,2-trifluoroethoxymethyl)oxolan-3-yl]methyl]propan-2-amine

2-methyl-N-[[2-methyl-3-(2,2,2-trifluoroethoxymethyl)oxolan-3-yl]methyl]propan-2-amine (PubChem CID 106706226) has the molecular formula C13H24F3NO2 and a molecular weight of 283.33 g/mol. Its IUPAC name is 2-methyl-N-[[2-methyl-3-(2,2,2-trifluoroethoxymethyl)oxolan-3-yl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[2-methyl-3-(2,2,2-trifluoroethoxymethyl)oxolan-3-yl]methyl]propan-2-amine
PubChem CID106706226
Molecular FormulaC13H24F3NO2
Molecular Weight283.33 g/mol
Exact Mass283.18
IUPAC Name2-methyl-N-[[2-methyl-3-(2,2,2-trifluoroethoxymethyl)oxolan-3-yl]methyl]propan-2-amine
SMILESCC1OCCC1(CNC(C)(C)C)COCC(F)(F)F
InChIInChI=1S/C13H24F3NO2/c1-10-12(5-6-19-10,7-17-11(2,3)4)8-18-9-13(14,15)16/h10,17H,5-9H2,1-4H3
InChIKeyPRKWEYMFQVAEGP-UHFFFAOYSA-N
XLogP2.75
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-methyl-N-[[2-methyl-3-(2,2,2-trifluoroethoxymethyl)oxolan-3-yl]methyl]propan-2-amine with MolForge

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Related Compounds

N-[[2-methyl-3-(2,2,2-trifluoroethoxymethyl)oxolan-3-yl]methyl]propan-2-amine
CID 106706225
2-methyl-N-[[2-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]oxolan-3-yl]methyl]propan-2-amine
CID 114535029
2-methyl-N-[[2-(2,2,2-trifluoroethoxymethyl)-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine
CID 106705987
N-[[3-(2-ethylsulfonylethyl)-2-methyloxolan-3-yl]methyl]-2-methylpropan-2-amine
CID 114535054
N-[[3-[(3,5-difluorophenyl)methyl]-2-methyloxolan-3-yl]methyl]-2-methylpropan-2-amine
CID 105408565
1-[3-(ethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine
CID 114534229
N-[[2-cyclopropyl-3-(2,2,2-trifluoroethoxymethyl)oxolan-3-yl]methyl]cyclopropanamine
CID 106706218
N-[[3-(3-ethylsulfonylpropyl)-2-methyloxolan-3-yl]methyl]-2-methylpropan-2-amine
CID 114534974
2-methyl-3-[2-(2,2,2-trifluoroethoxy)ethyl]oxolan-3-amine
CID 114535331
1-[3-(cyclopropylmethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine
CID 106930994
N-[[3-[(3-bromophenyl)methyl]-2-methyloxolan-3-yl]methyl]-2-methylpropan-2-amine
CID 114534984
2-methyl-N-[[2-methyl-3-[(1-methylpyrazol-4-yl)methyl]oxolan-3-yl]methyl]propan-2-amine
CID 114535006

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[2-methyl-3-(2,2,2-trifluoroethoxymethyl)oxolan-3-yl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[2-methyl-3-(2,2,2-trifluoroethoxymethyl)oxolan-3-yl]methyl]propan-2-amine (CID 106706226) is 2-methyl-N-[[2-methyl-3-(2,2,2-trifluoroethoxymethyl)oxolan-3-yl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[2-methyl-3-(2,2,2-trifluoroethoxymethyl)oxolan-3-yl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[2-methyl-3-(2,2,2-trifluoroethoxymethyl)oxolan-3-yl]methyl]propan-2-amine is CC1OCCC1(CNC(C)(C)C)COCC(F)(F)F.
What is the InChIKey of 2-methyl-N-[[2-methyl-3-(2,2,2-trifluoroethoxymethyl)oxolan-3-yl]methyl]propan-2-amine?
The InChIKey is PRKWEYMFQVAEGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24F3NO2/c1-10-12(5-6-19-10,7-17-11(2,3)4)8-18-9-13(14,15)16/h10,17H,5-9H2,1-4H3.
What are the key properties of 2-methyl-N-[[2-methyl-3-(2,2,2-trifluoroethoxymethyl)oxolan-3-yl]methyl]propan-2-amine?
2-methyl-N-[[2-methyl-3-(2,2,2-trifluoroethoxymethyl)oxolan-3-yl]methyl]propan-2-amine has a molecular weight of 283.33 g/mol, XLogP of 2.75, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[2-methyl-3-(2,2,2-trifluoroethoxymethyl)oxolan-3-yl]methyl]propan-2-amine is sourced from PubChem (CID 106706226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).