N,2-dimethyl-N-(2,2,2-trifluoroethyl)-2-azaspiro[3.3]heptan-6-amine

C10H17F3N2 — CID 118974451

IUPACN,2-dimethyl-N-(2,2,2-trifluoroethyl)-2-azaspiro[3.3]heptan-6-amine
SMILESCN1CC2(CC(N(C)CC(F)(F)F)C2)C1
InChIInChI=1S/C10H17F3N2/c1-14-5-9(6-14)3-8(4-9)15(2)7-10(11,12)13/h8H,3-7H2,1-2H3
InChIKeyQTGPZPYXLAZASQ-UHFFFAOYSA-N
MW222.25 g/mol
LogP1.57
Rot. Bonds2

About N,2-dimethyl-N-(2,2,2-trifluoroethyl)-2-azaspiro[3.3]heptan-6-amine

N,2-dimethyl-N-(2,2,2-trifluoroethyl)-2-azaspiro[3.3]heptan-6-amine (PubChem CID 118974451) has the molecular formula C10H17F3N2 and a molecular weight of 222.25 g/mol. Its IUPAC name is N,2-dimethyl-N-(2,2,2-trifluoroethyl)-2-azaspiro[3.3]heptan-6-amine.

Molecular Properties

Compound NameN,2-dimethyl-N-(2,2,2-trifluoroethyl)-2-azaspiro[3.3]heptan-6-amine
PubChem CID118974451
Molecular FormulaC10H17F3N2
Molecular Weight222.25 g/mol
Exact Mass222.13
IUPAC NameN,2-dimethyl-N-(2,2,2-trifluoroethyl)-2-azaspiro[3.3]heptan-6-amine
SMILESCN1CC2(CC(N(C)CC(F)(F)F)C2)C1
InChIInChI=1S/C10H17F3N2/c1-14-5-9(6-14)3-8(4-9)15(2)7-10(11,12)13/h8H,3-7H2,1-2H3
InChIKeyQTGPZPYXLAZASQ-UHFFFAOYSA-N
XLogP1.57
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-(2,2,2-trifluoroethyl)-2-azaspiro[3.3]heptan-6-amine?
The IUPAC name of N,2-dimethyl-N-(2,2,2-trifluoroethyl)-2-azaspiro[3.3]heptan-6-amine (CID 118974451) is N,2-dimethyl-N-(2,2,2-trifluoroethyl)-2-azaspiro[3.3]heptan-6-amine.
What is the SMILES notation for N,2-dimethyl-N-(2,2,2-trifluoroethyl)-2-azaspiro[3.3]heptan-6-amine?
The canonical SMILES for N,2-dimethyl-N-(2,2,2-trifluoroethyl)-2-azaspiro[3.3]heptan-6-amine is CN1CC2(CC(N(C)CC(F)(F)F)C2)C1.
What is the InChIKey of N,2-dimethyl-N-(2,2,2-trifluoroethyl)-2-azaspiro[3.3]heptan-6-amine?
The InChIKey is QTGPZPYXLAZASQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3N2/c1-14-5-9(6-14)3-8(4-9)15(2)7-10(11,12)13/h8H,3-7H2,1-2H3.
What are the key properties of N,2-dimethyl-N-(2,2,2-trifluoroethyl)-2-azaspiro[3.3]heptan-6-amine?
N,2-dimethyl-N-(2,2,2-trifluoroethyl)-2-azaspiro[3.3]heptan-6-amine has a molecular weight of 222.25 g/mol, XLogP of 1.57, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-(2,2,2-trifluoroethyl)-2-azaspiro[3.3]heptan-6-amine is sourced from PubChem (CID 118974451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).