5,5,5-trifluoro-N-methyl-1-(2-methyloxolan-3-yl)pentan-1-amine

C11H20F3NO — CID 105023849

IUPAC5,5,5-trifluoro-N-methyl-1-(2-methyloxolan-3-yl)pentan-1-amine
SMILESCNC(CCCC(F)(F)F)C1CCOC1C
InChIInChI=1S/C11H20F3NO/c1-8-9(5-7-16-8)10(15-2)4-3-6-11(12,13)14/h8-10,15H,3-7H2,1-2H3
InChIKeyQLIPPYNMMGNSRB-UHFFFAOYSA-N
MW239.28 g/mol
LogP2.73
Rot. Bonds5

About 5,5,5-trifluoro-N-methyl-1-(2-methyloxolan-3-yl)pentan-1-amine

5,5,5-trifluoro-N-methyl-1-(2-methyloxolan-3-yl)pentan-1-amine (PubChem CID 105023849) has the molecular formula C11H20F3NO and a molecular weight of 239.28 g/mol. Its IUPAC name is 5,5,5-trifluoro-N-methyl-1-(2-methyloxolan-3-yl)pentan-1-amine.

Molecular Properties

Compound Name5,5,5-trifluoro-N-methyl-1-(2-methyloxolan-3-yl)pentan-1-amine
PubChem CID105023849
Molecular FormulaC11H20F3NO
Molecular Weight239.28 g/mol
Exact Mass239.15
IUPAC Name5,5,5-trifluoro-N-methyl-1-(2-methyloxolan-3-yl)pentan-1-amine
SMILESCNC(CCCC(F)(F)F)C1CCOC1C
InChIInChI=1S/C11H20F3NO/c1-8-9(5-7-16-8)10(15-2)4-3-6-11(12,13)14/h8-10,15H,3-7H2,1-2H3
InChIKeyQLIPPYNMMGNSRB-UHFFFAOYSA-N
XLogP2.73
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5,5,5-trifluoro-N-methyl-1-(2-methyloxolan-3-yl)pentan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-Cyclohexyl-4,4-difluoro-5-propan-2-yloxypentan-2-amine
CID 54123882
N-butyl-5,5-difluoro-6-methoxy-4,7-dimethyloctan-1-amine
CID 146228722
(2S,3S,4S,5R)-4-fluoro-N-methyl-5-(2-methylpropyl)-2-propan-2-yloxolan-3-amine
CID 176612956
N-Methyl-2-[(oxolan-2-yl)methyl]cyclohexan-1-amine
CID 13025937
N-propyl-2-[2-(2,2,2-trifluoroethoxy)ethyl]cyclopentan-1-amine
CID 54962221
N-methyl-1-(4-methylcyclohexyl)-4-(2,2,2-trifluoroethoxy)butan-1-amine
CID 55093564
N-methyl-1-(3-methylcyclohexyl)-4-(2,2,2-trifluoroethoxy)butan-1-amine
CID 55094199
1-cyclopentyl-N-ethyl-3-(2,2,2-trifluoroethoxy)propan-1-amine
CID 55094981
1-cyclohexyl-N-methyl-4-(2,2,2-trifluoroethoxy)butan-1-amine
CID 55095357
N,7-dimethyl-1-(2,2,2-trifluoroethoxy)octan-4-amine
CID 55095372
N-ethyl-6-methyl-1-(2,2,2-trifluoroethoxy)heptan-3-amine
CID 55095373
6-methyl-N-propyl-1-(2,2,2-trifluoroethoxy)heptan-3-amine
CID 55095421

Frequently Asked Questions

What is the IUPAC name of 5,5,5-trifluoro-N-methyl-1-(2-methyloxolan-3-yl)pentan-1-amine?
The IUPAC name of 5,5,5-trifluoro-N-methyl-1-(2-methyloxolan-3-yl)pentan-1-amine (CID 105023849) is 5,5,5-trifluoro-N-methyl-1-(2-methyloxolan-3-yl)pentan-1-amine.
What is the SMILES notation for 5,5,5-trifluoro-N-methyl-1-(2-methyloxolan-3-yl)pentan-1-amine?
The canonical SMILES for 5,5,5-trifluoro-N-methyl-1-(2-methyloxolan-3-yl)pentan-1-amine is CNC(CCCC(F)(F)F)C1CCOC1C.
What is the InChIKey of 5,5,5-trifluoro-N-methyl-1-(2-methyloxolan-3-yl)pentan-1-amine?
The InChIKey is QLIPPYNMMGNSRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20F3NO/c1-8-9(5-7-16-8)10(15-2)4-3-6-11(12,13)14/h8-10,15H,3-7H2,1-2H3.
What are the key properties of 5,5,5-trifluoro-N-methyl-1-(2-methyloxolan-3-yl)pentan-1-amine?
5,5,5-trifluoro-N-methyl-1-(2-methyloxolan-3-yl)pentan-1-amine has a molecular weight of 239.28 g/mol, XLogP of 2.73, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5,5-trifluoro-N-methyl-1-(2-methyloxolan-3-yl)pentan-1-amine is sourced from PubChem (CID 105023849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).