1-cyclopentyl-N-ethyl-2-(2-fluorophenoxy)ethanamine

C15H22FNO — CID 113448545

IUPAC1-cyclopentyl-N-ethyl-2-(2-fluorophenoxy)ethanamine
SMILESCCNC(COc1ccccc1F)C1CCCC1
InChIInChI=1S/C15H22FNO/c1-2-17-14(12-7-3-4-8-12)11-18-15-10-6-5-9-13(15)16/h5-6,9-10,12,14,17H,2-4,7-8,11H2,1H3
InChIKeyXYBSMKCSFZRRPL-UHFFFAOYSA-N
MW251.34 g/mol
LogP3.37
Rot. Bonds6

About 1-cyclopentyl-N-ethyl-2-(2-fluorophenoxy)ethanamine

1-cyclopentyl-N-ethyl-2-(2-fluorophenoxy)ethanamine (PubChem CID 113448545) has the molecular formula C15H22FNO and a molecular weight of 251.34 g/mol. Its IUPAC name is 1-cyclopentyl-N-ethyl-2-(2-fluorophenoxy)ethanamine.

Molecular Properties

Compound Name1-cyclopentyl-N-ethyl-2-(2-fluorophenoxy)ethanamine
PubChem CID113448545
Molecular FormulaC15H22FNO
Molecular Weight251.34 g/mol
Exact Mass251.17
IUPAC Name1-cyclopentyl-N-ethyl-2-(2-fluorophenoxy)ethanamine
SMILESCCNC(COc1ccccc1F)C1CCCC1
InChIInChI=1S/C15H22FNO/c1-2-17-14(12-7-3-4-8-12)11-18-15-10-6-5-9-13(15)16/h5-6,9-10,12,14,17H,2-4,7-8,11H2,1H3
InChIKeyXYBSMKCSFZRRPL-UHFFFAOYSA-N
XLogP3.37
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.34
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-tert-butylphenoxy)-1-cyclopropyl-N-ethylethanamine
CID 63912498
1-cyclohexyl-N-ethyl-2-[(2-fluorophenyl)methoxy]ethanamine
CID 104749468
1-cyclopropyl-N-ethyl-2-(2-ethylphenoxy)ethanamine
CID 63906895
N-[1-cyclohexyl-2-(2,4-difluorophenoxy)ethyl]propan-1-amine
CID 104748323
N-[1-cyclopentyl-2-(2-ethoxyphenoxy)ethyl]propan-1-amine
CID 104748399
1-cyclohexyl-N-ethyl-2-(2,3,5-trimethylphenoxy)ethanamine
CID 104748853
1-[[(1S)-1-cyclopentylethyl]amino]-3-(2-fluorophenoxy)propan-2-ol
CID 81395407
N-[2-(2-chlorophenoxy)-1-cyclopentylethyl]propan-1-amine
CID 104749295
N-[1-cyclopentyl-2-(2-propan-2-ylphenoxy)ethyl]propan-1-amine
CID 104748610
1-cyclopentyl-N-ethyl-2-(3-methoxyphenoxy)ethanamine
CID 104748428
1-cyclooctyl-N-ethyl-2-(2-methoxyphenyl)ethanamine
CID 65018291
N-[1-cyclopropyl-2-(2,5-difluorophenoxy)ethyl]propan-1-amine
CID 63906071

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-ethyl-2-(2-fluorophenoxy)ethanamine?
The IUPAC name of 1-cyclopentyl-N-ethyl-2-(2-fluorophenoxy)ethanamine (CID 113448545) is 1-cyclopentyl-N-ethyl-2-(2-fluorophenoxy)ethanamine.
What is the SMILES notation for 1-cyclopentyl-N-ethyl-2-(2-fluorophenoxy)ethanamine?
The canonical SMILES for 1-cyclopentyl-N-ethyl-2-(2-fluorophenoxy)ethanamine is CCNC(COc1ccccc1F)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-N-ethyl-2-(2-fluorophenoxy)ethanamine?
The InChIKey is XYBSMKCSFZRRPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FNO/c1-2-17-14(12-7-3-4-8-12)11-18-15-10-6-5-9-13(15)16/h5-6,9-10,12,14,17H,2-4,7-8,11H2,1H3.
What are the key properties of 1-cyclopentyl-N-ethyl-2-(2-fluorophenoxy)ethanamine?
1-cyclopentyl-N-ethyl-2-(2-fluorophenoxy)ethanamine has a molecular weight of 251.34 g/mol, XLogP of 3.37, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-ethyl-2-(2-fluorophenoxy)ethanamine is sourced from PubChem (CID 113448545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).