1-(1-ethoxycyclopentyl)-2-(3-fluorophenyl)ethanamine

C15H22FNO — CID 116761667

IUPAC1-(1-ethoxycyclopentyl)-2-(3-fluorophenyl)ethanamine
SMILESCCOC1(C(N)Cc2cccc(F)c2)CCCC1
InChIInChI=1S/C15H22FNO/c1-2-18-15(8-3-4-9-15)14(17)11-12-6-5-7-13(16)10-12/h5-7,10,14H,2-4,8-9,11,17H2,1H3
InChIKeyGUWVCNFFHFYNDX-UHFFFAOYSA-N
MW251.34 g/mol
LogP3.04
Rot. Bonds5

About 1-(1-ethoxycyclopentyl)-2-(3-fluorophenyl)ethanamine

1-(1-ethoxycyclopentyl)-2-(3-fluorophenyl)ethanamine (PubChem CID 116761667) has the molecular formula C15H22FNO and a molecular weight of 251.34 g/mol. Its IUPAC name is 1-(1-ethoxycyclopentyl)-2-(3-fluorophenyl)ethanamine.

Molecular Properties

Compound Name1-(1-ethoxycyclopentyl)-2-(3-fluorophenyl)ethanamine
PubChem CID116761667
Molecular FormulaC15H22FNO
Molecular Weight251.34 g/mol
Exact Mass251.17
IUPAC Name1-(1-ethoxycyclopentyl)-2-(3-fluorophenyl)ethanamine
SMILESCCOC1(C(N)Cc2cccc(F)c2)CCCC1
InChIInChI=1S/C15H22FNO/c1-2-18-15(8-3-4-9-15)14(17)11-12-6-5-7-13(16)10-12/h5-7,10,14H,2-4,8-9,11,17H2,1H3
InChIKeyGUWVCNFFHFYNDX-UHFFFAOYSA-N
XLogP3.04
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.34
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-ethoxycyclohexyl)-N-ethyl-2-(3-fluorophenyl)ethanamine
CID 116764071
2-(3-bromo-5-fluorophenyl)-1-(1-ethoxycyclohexyl)ethanamine
CID 116763561
2-(3-chloro-4-fluorophenyl)-1-(1-ethoxycyclopentyl)ethanamine
CID 103040524
2-(2-bromo-4-fluorophenyl)-1-(1-ethoxycyclopentyl)ethanamine
CID 116761603
[(1-ethoxycyclohexyl)-(3-fluorophenyl)methyl]hydrazine
CID 105276324
1-(1-ethoxy-4-methylcyclohexyl)-2-(3-fluorophenyl)ethanol
CID 116754724
1-(1-ethoxycycloheptyl)-2-(furan-3-yl)ethanamine
CID 116770604
2-(2,3-dichlorophenyl)-1-(1-ethoxycycloheptyl)ethanamine
CID 107309137
1-(1-ethoxycyclopentyl)-2-(furan-2-yl)ethanamine
CID 116761654
1-(1-ethoxycyclohexyl)-1-(3-fluorophenyl)-N-methylmethanamine
CID 116763933
N-[(1-ethoxycycloheptyl)-(3-fluorophenyl)methyl]ethanamine
CID 116771021
1-(1-ethoxy-3-methylcyclohexyl)-2-phenylethanamine
CID 116768003

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethoxycyclopentyl)-2-(3-fluorophenyl)ethanamine?
The IUPAC name of 1-(1-ethoxycyclopentyl)-2-(3-fluorophenyl)ethanamine (CID 116761667) is 1-(1-ethoxycyclopentyl)-2-(3-fluorophenyl)ethanamine.
What is the SMILES notation for 1-(1-ethoxycyclopentyl)-2-(3-fluorophenyl)ethanamine?
The canonical SMILES for 1-(1-ethoxycyclopentyl)-2-(3-fluorophenyl)ethanamine is CCOC1(C(N)Cc2cccc(F)c2)CCCC1.
What is the InChIKey of 1-(1-ethoxycyclopentyl)-2-(3-fluorophenyl)ethanamine?
The InChIKey is GUWVCNFFHFYNDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FNO/c1-2-18-15(8-3-4-9-15)14(17)11-12-6-5-7-13(16)10-12/h5-7,10,14H,2-4,8-9,11,17H2,1H3.
What are the key properties of 1-(1-ethoxycyclopentyl)-2-(3-fluorophenyl)ethanamine?
1-(1-ethoxycyclopentyl)-2-(3-fluorophenyl)ethanamine has a molecular weight of 251.34 g/mol, XLogP of 3.04, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethoxycyclopentyl)-2-(3-fluorophenyl)ethanamine is sourced from PubChem (CID 116761667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).