2-cyclopentyl-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine

C15H26F3N — CID 105139095

IUPAC2-cyclopentyl-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine
SMILESCNC(CC1CCCC1)C1CCCCC1C(F)(F)F
InChIInChI=1S/C15H26F3N/c1-19-14(10-11-6-2-3-7-11)12-8-4-5-9-13(12)15(16,17)18/h11-14,19H,2-10H2,1H3
InChIKeyVBPGZQFGQRFFEE-UHFFFAOYSA-N
MW277.37 g/mol
LogP4.52
Rot. Bonds4

About 2-cyclopentyl-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine

2-cyclopentyl-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine (PubChem CID 105139095) has the molecular formula C15H26F3N and a molecular weight of 277.37 g/mol. Its IUPAC name is 2-cyclopentyl-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine.

Molecular Properties

Compound Name2-cyclopentyl-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine
PubChem CID105139095
Molecular FormulaC15H26F3N
Molecular Weight277.37 g/mol
Exact Mass277.20
IUPAC Name2-cyclopentyl-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine
SMILESCNC(CC1CCCC1)C1CCCCC1C(F)(F)F
InChIInChI=1S/C15H26F3N/c1-19-14(10-11-6-2-3-7-11)12-8-4-5-9-13(12)15(16,17)18/h11-14,19H,2-10H2,1H3
InChIKeyVBPGZQFGQRFFEE-UHFFFAOYSA-N
XLogP4.52
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine?
The IUPAC name of 2-cyclopentyl-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine (CID 105139095) is 2-cyclopentyl-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine.
What is the SMILES notation for 2-cyclopentyl-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine?
The canonical SMILES for 2-cyclopentyl-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine is CNC(CC1CCCC1)C1CCCCC1C(F)(F)F.
What is the InChIKey of 2-cyclopentyl-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine?
The InChIKey is VBPGZQFGQRFFEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26F3N/c1-19-14(10-11-6-2-3-7-11)12-8-4-5-9-13(12)15(16,17)18/h11-14,19H,2-10H2,1H3.
What are the key properties of 2-cyclopentyl-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine?
2-cyclopentyl-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine has a molecular weight of 277.37 g/mol, XLogP of 4.52, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine is sourced from PubChem (CID 105139095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).