2-methoxy-N-[3-(trifluoromethyl)cyclohexyl]cyclohexan-1-amine

C14H24F3NO — CID 43791411

IUPAC2-methoxy-N-[3-(trifluoromethyl)cyclohexyl]cyclohexan-1-amine
SMILESCOC1CCCCC1NC1CCCC(C(F)(F)F)C1
InChIInChI=1S/C14H24F3NO/c1-19-13-8-3-2-7-12(13)18-11-6-4-5-10(9-11)14(15,16)17/h10-13,18H,2-9H2,1H3
InChIKeyOKCWBIQWUGDCHM-UHFFFAOYSA-N
MW279.35 g/mol
LogP3.65
Rot. Bonds3

About 2-methoxy-N-[3-(trifluoromethyl)cyclohexyl]cyclohexan-1-amine

2-methoxy-N-[3-(trifluoromethyl)cyclohexyl]cyclohexan-1-amine (PubChem CID 43791411) has the molecular formula C14H24F3NO and a molecular weight of 279.35 g/mol. Its IUPAC name is 2-methoxy-N-[3-(trifluoromethyl)cyclohexyl]cyclohexan-1-amine.

Molecular Properties

Compound Name2-methoxy-N-[3-(trifluoromethyl)cyclohexyl]cyclohexan-1-amine
PubChem CID43791411
Molecular FormulaC14H24F3NO
Molecular Weight279.35 g/mol
Exact Mass279.18
IUPAC Name2-methoxy-N-[3-(trifluoromethyl)cyclohexyl]cyclohexan-1-amine
SMILESCOC1CCCCC1NC1CCCC(C(F)(F)F)C1
InChIInChI=1S/C14H24F3NO/c1-19-13-8-3-2-7-12(13)18-11-6-4-5-10(9-11)14(15,16)17/h10-13,18H,2-9H2,1H3
InChIKeyOKCWBIQWUGDCHM-UHFFFAOYSA-N
XLogP3.65
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.35
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-methoxy-N-[3-(trifluoromethyl)cyclohexyl]cyclohexan-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

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[3-(trifluoromethyl)cyclohexyl]cyclohexan-1-amine?
The IUPAC name of 2-methoxy-N-[3-(trifluoromethyl)cyclohexyl]cyclohexan-1-amine (CID 43791411) is 2-methoxy-N-[3-(trifluoromethyl)cyclohexyl]cyclohexan-1-amine.
What is the SMILES notation for 2-methoxy-N-[3-(trifluoromethyl)cyclohexyl]cyclohexan-1-amine?
The canonical SMILES for 2-methoxy-N-[3-(trifluoromethyl)cyclohexyl]cyclohexan-1-amine is COC1CCCCC1NC1CCCC(C(F)(F)F)C1.
What is the InChIKey of 2-methoxy-N-[3-(trifluoromethyl)cyclohexyl]cyclohexan-1-amine?
The InChIKey is OKCWBIQWUGDCHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24F3NO/c1-19-13-8-3-2-7-12(13)18-11-6-4-5-10(9-11)14(15,16)17/h10-13,18H,2-9H2,1H3.
What are the key properties of 2-methoxy-N-[3-(trifluoromethyl)cyclohexyl]cyclohexan-1-amine?
2-methoxy-N-[3-(trifluoromethyl)cyclohexyl]cyclohexan-1-amine has a molecular weight of 279.35 g/mol, XLogP of 3.65, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[3-(trifluoromethyl)cyclohexyl]cyclohexan-1-amine is sourced from PubChem (CID 43791411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).