2-cyclohexyloxy-1-(2,5-difluorophenyl)ethanamine

C14H19F2NO — CID 16793773

IUPAC2-cyclohexyloxy-1-(2,5-difluorophenyl)ethanamine
SMILESNC(COC1CCCCC1)c1cc(F)ccc1F
InChIInChI=1S/C14H19F2NO/c15-10-6-7-13(16)12(8-10)14(17)9-18-11-4-2-1-3-5-11/h6-8,11,14H,1-5,9,17H2
InChIKeyGEZQSFFCXQZFRU-UHFFFAOYSA-N
MW255.31 g/mol
LogP3.31
Rot. Bonds4

About 2-cyclohexyloxy-1-(2,5-difluorophenyl)ethanamine

2-cyclohexyloxy-1-(2,5-difluorophenyl)ethanamine (PubChem CID 16793773) has the molecular formula C14H19F2NO and a molecular weight of 255.31 g/mol. Its IUPAC name is 2-cyclohexyloxy-1-(2,5-difluorophenyl)ethanamine.

Molecular Properties

Compound Name2-cyclohexyloxy-1-(2,5-difluorophenyl)ethanamine
PubChem CID16793773
Molecular FormulaC14H19F2NO
Molecular Weight255.31 g/mol
Exact Mass255.14
IUPAC Name2-cyclohexyloxy-1-(2,5-difluorophenyl)ethanamine
SMILESNC(COC1CCCCC1)c1cc(F)ccc1F
InChIInChI=1S/C14H19F2NO/c15-10-6-7-13(16)12(8-10)14(17)9-18-11-4-2-1-3-5-11/h6-8,11,14H,1-5,9,17H2
InChIKeyGEZQSFFCXQZFRU-UHFFFAOYSA-N
XLogP3.31
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.31
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyloxy-1-(2,5-difluorophenyl)ethanamine?
The IUPAC name of 2-cyclohexyloxy-1-(2,5-difluorophenyl)ethanamine (CID 16793773) is 2-cyclohexyloxy-1-(2,5-difluorophenyl)ethanamine.
What is the SMILES notation for 2-cyclohexyloxy-1-(2,5-difluorophenyl)ethanamine?
The canonical SMILES for 2-cyclohexyloxy-1-(2,5-difluorophenyl)ethanamine is NC(COC1CCCCC1)c1cc(F)ccc1F.
What is the InChIKey of 2-cyclohexyloxy-1-(2,5-difluorophenyl)ethanamine?
The InChIKey is GEZQSFFCXQZFRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F2NO/c15-10-6-7-13(16)12(8-10)14(17)9-18-11-4-2-1-3-5-11/h6-8,11,14H,1-5,9,17H2.
What are the key properties of 2-cyclohexyloxy-1-(2,5-difluorophenyl)ethanamine?
2-cyclohexyloxy-1-(2,5-difluorophenyl)ethanamine has a molecular weight of 255.31 g/mol, XLogP of 3.31, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyloxy-1-(2,5-difluorophenyl)ethanamine is sourced from PubChem (CID 16793773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).