1-cyclohexyl-5,5,5-trifluoro-1-methoxy-N-methylpentan-2-amine

C13H24F3NO — CID 116771494

IUPAC1-cyclohexyl-5,5,5-trifluoro-1-methoxy-N-methylpentan-2-amine
SMILESCNC(CCC(F)(F)F)C(OC)C1CCCCC1
InChIInChI=1S/C13H24F3NO/c1-17-11(8-9-13(14,15)16)12(18-2)10-6-4-3-5-7-10/h10-12,17H,3-9H2,1-2H3
InChIKeyODFQZKUSBFPVRF-UHFFFAOYSA-N
MW267.33 g/mol
LogP3.51
Rot. Bonds6

About 1-cyclohexyl-5,5,5-trifluoro-1-methoxy-N-methylpentan-2-amine

1-cyclohexyl-5,5,5-trifluoro-1-methoxy-N-methylpentan-2-amine (PubChem CID 116771494) has the molecular formula C13H24F3NO and a molecular weight of 267.33 g/mol. Its IUPAC name is 1-cyclohexyl-5,5,5-trifluoro-1-methoxy-N-methylpentan-2-amine.

Molecular Properties

Compound Name1-cyclohexyl-5,5,5-trifluoro-1-methoxy-N-methylpentan-2-amine
PubChem CID116771494
Molecular FormulaC13H24F3NO
Molecular Weight267.33 g/mol
Exact Mass267.18
IUPAC Name1-cyclohexyl-5,5,5-trifluoro-1-methoxy-N-methylpentan-2-amine
SMILESCNC(CCC(F)(F)F)C(OC)C1CCCCC1
InChIInChI=1S/C13H24F3NO/c1-17-11(8-9-13(14,15)16)12(18-2)10-6-4-3-5-7-10/h10-12,17H,3-9H2,1-2H3
InChIKeyODFQZKUSBFPVRF-UHFFFAOYSA-N
XLogP3.51
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-cyclohexyl-5,5,5-trifluoro-1-methoxy-N-methylpentan-2-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-5,5,5-trifluoro-1-methoxy-N-methylpentan-2-amine?
The IUPAC name of 1-cyclohexyl-5,5,5-trifluoro-1-methoxy-N-methylpentan-2-amine (CID 116771494) is 1-cyclohexyl-5,5,5-trifluoro-1-methoxy-N-methylpentan-2-amine.
What is the SMILES notation for 1-cyclohexyl-5,5,5-trifluoro-1-methoxy-N-methylpentan-2-amine?
The canonical SMILES for 1-cyclohexyl-5,5,5-trifluoro-1-methoxy-N-methylpentan-2-amine is CNC(CCC(F)(F)F)C(OC)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-5,5,5-trifluoro-1-methoxy-N-methylpentan-2-amine?
The InChIKey is ODFQZKUSBFPVRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24F3NO/c1-17-11(8-9-13(14,15)16)12(18-2)10-6-4-3-5-7-10/h10-12,17H,3-9H2,1-2H3.
What are the key properties of 1-cyclohexyl-5,5,5-trifluoro-1-methoxy-N-methylpentan-2-amine?
1-cyclohexyl-5,5,5-trifluoro-1-methoxy-N-methylpentan-2-amine has a molecular weight of 267.33 g/mol, XLogP of 3.51, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-5,5,5-trifluoro-1-methoxy-N-methylpentan-2-amine is sourced from PubChem (CID 116771494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).