5-(oxolan-2-yl)-1-(2,2,2-trifluoroethoxy)pentan-2-amine

C11H20F3NO2 — CID 103215531

IUPAC5-(oxolan-2-yl)-1-(2,2,2-trifluoroethoxy)pentan-2-amine
SMILESNC(CCCC1CCCO1)COCC(F)(F)F
InChIInChI=1S/C11H20F3NO2/c12-11(13,14)8-16-7-9(15)3-1-4-10-5-2-6-17-10/h9-10H,1-8,15H2
InChIKeyKFZCNCINHCZWMI-UHFFFAOYSA-N
MW255.28 g/mol
LogP2.24
Rot. Bonds7

About 5-(oxolan-2-yl)-1-(2,2,2-trifluoroethoxy)pentan-2-amine

5-(oxolan-2-yl)-1-(2,2,2-trifluoroethoxy)pentan-2-amine (PubChem CID 103215531) has the molecular formula C11H20F3NO2 and a molecular weight of 255.28 g/mol. Its IUPAC name is 5-(oxolan-2-yl)-1-(2,2,2-trifluoroethoxy)pentan-2-amine.

Molecular Properties

Compound Name5-(oxolan-2-yl)-1-(2,2,2-trifluoroethoxy)pentan-2-amine
PubChem CID103215531
Molecular FormulaC11H20F3NO2
Molecular Weight255.28 g/mol
Exact Mass255.14
IUPAC Name5-(oxolan-2-yl)-1-(2,2,2-trifluoroethoxy)pentan-2-amine
SMILESNC(CCCC1CCCO1)COCC(F)(F)F
InChIInChI=1S/C11H20F3NO2/c12-11(13,14)8-16-7-9(15)3-1-4-10-5-2-6-17-10/h9-10H,1-8,15H2
InChIKeyKFZCNCINHCZWMI-UHFFFAOYSA-N
XLogP2.24
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.28
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,2-Difluoro-1-(oxolan-2-yl)ethan-1-amine
CID 80606054
2,2,2-Trifluoro-1-(oxolan-2-yl)ethan-1-amine hydrochloride
CID 138110052
2,2,2-Trifluoro-1-(oxolan-2-yl)ethan-1-amine
CID 66467484
2-(2,2,2-Trifluoroethoxy)cyclooctan-1-amine
CID 16793881
2-(2,2,2-Trifluoroethoxy)cyclododecan-1-amine
CID 45281829
2-(2,2,3,3-Tetrafluoropropoxy)cyclooctan-1-amine
CID 45283077
4,4,4-Trifluoro-1-(oxolan-2-yl)butan-2-amine
CID 62604262
5,5,5-Trifluoro-1-(oxolan-2-yl)pentan-2-amine
CID 64567828
1,1,1-Trifluoro-6-(oxolan-2-yl)hexan-3-amine
CID 65164238
1,1,1-Trifluoro-5-(oxolan-2-yl)pentan-3-amine
CID 65164286
4,4,4-trifluoro-N-methyl-1-(oxolan-2-yl)butan-1-amine
CID 65328458
4,4,4-Trifluoro-1-(oxolan-2-yl)butan-1-amine
CID 65331595

Frequently Asked Questions

What is the IUPAC name of 5-(oxolan-2-yl)-1-(2,2,2-trifluoroethoxy)pentan-2-amine?
The IUPAC name of 5-(oxolan-2-yl)-1-(2,2,2-trifluoroethoxy)pentan-2-amine (CID 103215531) is 5-(oxolan-2-yl)-1-(2,2,2-trifluoroethoxy)pentan-2-amine.
What is the SMILES notation for 5-(oxolan-2-yl)-1-(2,2,2-trifluoroethoxy)pentan-2-amine?
The canonical SMILES for 5-(oxolan-2-yl)-1-(2,2,2-trifluoroethoxy)pentan-2-amine is NC(CCCC1CCCO1)COCC(F)(F)F.
What is the InChIKey of 5-(oxolan-2-yl)-1-(2,2,2-trifluoroethoxy)pentan-2-amine?
The InChIKey is KFZCNCINHCZWMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20F3NO2/c12-11(13,14)8-16-7-9(15)3-1-4-10-5-2-6-17-10/h9-10H,1-8,15H2.
What are the key properties of 5-(oxolan-2-yl)-1-(2,2,2-trifluoroethoxy)pentan-2-amine?
5-(oxolan-2-yl)-1-(2,2,2-trifluoroethoxy)pentan-2-amine has a molecular weight of 255.28 g/mol, XLogP of 2.24, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(oxolan-2-yl)-1-(2,2,2-trifluoroethoxy)pentan-2-amine is sourced from PubChem (CID 103215531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).