N,4,4-trimethyl-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine

C11H20F3N — CID 123771116

IUPACN,4,4-trimethyl-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine
SMILESCN(CC(F)(F)F)C1CCC(C)(C)CC1
InChIInChI=1S/C11H20F3N/c1-10(2)6-4-9(5-7-10)15(3)8-11(12,13)14/h9H,4-8H2,1-3H3
InChIKeyUFURTZMXLADRQK-UHFFFAOYSA-N
MW223.28 g/mol
LogP3.45
Rot. Bonds2

About N,4,4-trimethyl-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine

N,4,4-trimethyl-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine (PubChem CID 123771116) has the molecular formula C11H20F3N and a molecular weight of 223.28 g/mol. Its IUPAC name is N,4,4-trimethyl-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine.

Molecular Properties

Compound NameN,4,4-trimethyl-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine
PubChem CID123771116
Molecular FormulaC11H20F3N
Molecular Weight223.28 g/mol
Exact Mass223.15
IUPAC NameN,4,4-trimethyl-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine
SMILESCN(CC(F)(F)F)C1CCC(C)(C)CC1
InChIInChI=1S/C11H20F3N/c1-10(2)6-4-9(5-7-10)15(3)8-11(12,13)14/h9H,4-8H2,1-3H3
InChIKeyUFURTZMXLADRQK-UHFFFAOYSA-N
XLogP3.45
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,4,4-trimethyl-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine?
The IUPAC name of N,4,4-trimethyl-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine (CID 123771116) is N,4,4-trimethyl-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine.
What is the SMILES notation for N,4,4-trimethyl-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine?
The canonical SMILES for N,4,4-trimethyl-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine is CN(CC(F)(F)F)C1CCC(C)(C)CC1.
What is the InChIKey of N,4,4-trimethyl-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine?
The InChIKey is UFURTZMXLADRQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20F3N/c1-10(2)6-4-9(5-7-10)15(3)8-11(12,13)14/h9H,4-8H2,1-3H3.
What are the key properties of N,4,4-trimethyl-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine?
N,4,4-trimethyl-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine has a molecular weight of 223.28 g/mol, XLogP of 3.45, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,4,4-trimethyl-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine is sourced from PubChem (CID 123771116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).