1-(1-fluoroethoxy)-1-phenylethanamine

C10H14FNO — CID 67503438

IUPAC1-(1-fluoroethoxy)-1-phenylethanamine
SMILESCC(F)OC(C)(N)c1ccccc1
InChIInChI=1S/C10H14FNO/c1-8(11)13-10(2,12)9-6-4-3-5-7-9/h3-8H,12H2,1-2H3
InChIKeySQEPAUNLTSMMGP-UHFFFAOYSA-N
MW183.23 g/mol
LogP2.15
Rot. Bonds3

About 1-(1-fluoroethoxy)-1-phenylethanamine

1-(1-fluoroethoxy)-1-phenylethanamine (PubChem CID 67503438) has the molecular formula C10H14FNO and a molecular weight of 183.23 g/mol. Its IUPAC name is 1-(1-fluoroethoxy)-1-phenylethanamine.

Molecular Properties

Compound Name1-(1-fluoroethoxy)-1-phenylethanamine
PubChem CID67503438
Molecular FormulaC10H14FNO
Molecular Weight183.23 g/mol
Exact Mass183.11
IUPAC Name1-(1-fluoroethoxy)-1-phenylethanamine
SMILESCC(F)OC(C)(N)c1ccccc1
InChIInChI=1S/C10H14FNO/c1-8(11)13-10(2,12)9-6-4-3-5-7-9/h3-8H,12H2,1-2H3
InChIKeySQEPAUNLTSMMGP-UHFFFAOYSA-N
XLogP2.15
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.23
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(1-fluoroethoxy)-1-phenylethanamine?
The IUPAC name of 1-(1-fluoroethoxy)-1-phenylethanamine (CID 67503438) is 1-(1-fluoroethoxy)-1-phenylethanamine.
What is the SMILES notation for 1-(1-fluoroethoxy)-1-phenylethanamine?
The canonical SMILES for 1-(1-fluoroethoxy)-1-phenylethanamine is CC(F)OC(C)(N)c1ccccc1.
What is the InChIKey of 1-(1-fluoroethoxy)-1-phenylethanamine?
The InChIKey is SQEPAUNLTSMMGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FNO/c1-8(11)13-10(2,12)9-6-4-3-5-7-9/h3-8H,12H2,1-2H3.
What are the key properties of 1-(1-fluoroethoxy)-1-phenylethanamine?
1-(1-fluoroethoxy)-1-phenylethanamine has a molecular weight of 183.23 g/mol, XLogP of 2.15, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-fluoroethoxy)-1-phenylethanamine is sourced from PubChem (CID 67503438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).