1-cyclopropyl-2-(2-fluoroethylamino)ethanol

C7H14FNO — CID 80694705

IUPAC1-cyclopropyl-2-(2-fluoroethylamino)ethanol
SMILESOC(CNCCF)C1CC1
InChIInChI=1S/C7H14FNO/c8-3-4-9-5-7(10)6-1-2-6/h6-7,9-10H,1-5H2
InChIKeyZUTKXPOUZMMYSS-UHFFFAOYSA-N
MW147.19 g/mol
LogP0.32
Rot. Bonds5

About 1-cyclopropyl-2-(2-fluoroethylamino)ethanol

1-cyclopropyl-2-(2-fluoroethylamino)ethanol (PubChem CID 80694705) has the molecular formula C7H14FNO and a molecular weight of 147.19 g/mol. Its IUPAC name is 1-cyclopropyl-2-(2-fluoroethylamino)ethanol.

Molecular Properties

Compound Name1-cyclopropyl-2-(2-fluoroethylamino)ethanol
PubChem CID80694705
Molecular FormulaC7H14FNO
Molecular Weight147.19 g/mol
Exact Mass147.11
IUPAC Name1-cyclopropyl-2-(2-fluoroethylamino)ethanol
SMILESOC(CNCCF)C1CC1
InChIInChI=1S/C7H14FNO/c8-3-4-9-5-7(10)6-1-2-6/h6-7,9-10H,1-5H2
InChIKeyZUTKXPOUZMMYSS-UHFFFAOYSA-N
XLogP0.32
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.19
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-(2-fluoroethylamino)ethanol?
The IUPAC name of 1-cyclopropyl-2-(2-fluoroethylamino)ethanol (CID 80694705) is 1-cyclopropyl-2-(2-fluoroethylamino)ethanol.
What is the SMILES notation for 1-cyclopropyl-2-(2-fluoroethylamino)ethanol?
The canonical SMILES for 1-cyclopropyl-2-(2-fluoroethylamino)ethanol is OC(CNCCF)C1CC1.
What is the InChIKey of 1-cyclopropyl-2-(2-fluoroethylamino)ethanol?
The InChIKey is ZUTKXPOUZMMYSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14FNO/c8-3-4-9-5-7(10)6-1-2-6/h6-7,9-10H,1-5H2.
What are the key properties of 1-cyclopropyl-2-(2-fluoroethylamino)ethanol?
1-cyclopropyl-2-(2-fluoroethylamino)ethanol has a molecular weight of 147.19 g/mol, XLogP of 0.32, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-(2-fluoroethylamino)ethanol is sourced from PubChem (CID 80694705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).