2-(2-fluoroethoxy)-N-hexylacetamide

C10H20FNO2 — CID 177213455

IUPAC2-(2-fluoroethoxy)-N-hexylacetamide
SMILESCCCCCCNC(=O)COCCF
InChIInChI=1S/C10H20FNO2/c1-2-3-4-5-7-12-10(13)9-14-8-6-11/h2-9H2,1H3,(H,12,13)
InChIKeyRXBUZZSGTNJDNC-UHFFFAOYSA-N
MW205.27 g/mol
LogP1.67
Rot. Bonds9

About 2-(2-fluoroethoxy)-N-hexylacetamide

2-(2-fluoroethoxy)-N-hexylacetamide (PubChem CID 177213455) has the molecular formula C10H20FNO2 and a molecular weight of 205.27 g/mol. Its IUPAC name is 2-(2-fluoroethoxy)-N-hexylacetamide.

Molecular Properties

Compound Name2-(2-fluoroethoxy)-N-hexylacetamide
PubChem CID177213455
Molecular FormulaC10H20FNO2
Molecular Weight205.27 g/mol
Exact Mass205.15
IUPAC Name2-(2-fluoroethoxy)-N-hexylacetamide
SMILESCCCCCCNC(=O)COCCF
InChIInChI=1S/C10H20FNO2/c1-2-3-4-5-7-12-10(13)9-14-8-6-11/h2-9H2,1H3,(H,12,13)
InChIKeyRXBUZZSGTNJDNC-UHFFFAOYSA-N
XLogP1.67
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.27
LogP ≤ 51.67
H-Bond Donors ≤ 51
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 2-(2-fluoroethoxy)-N-hexylacetamide?
The IUPAC name of 2-(2-fluoroethoxy)-N-hexylacetamide (CID 177213455) is 2-(2-fluoroethoxy)-N-hexylacetamide.
What is the SMILES notation for 2-(2-fluoroethoxy)-N-hexylacetamide?
The canonical SMILES for 2-(2-fluoroethoxy)-N-hexylacetamide is CCCCCCNC(=O)COCCF.
What is the InChIKey of 2-(2-fluoroethoxy)-N-hexylacetamide?
The InChIKey is RXBUZZSGTNJDNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20FNO2/c1-2-3-4-5-7-12-10(13)9-14-8-6-11/h2-9H2,1H3,(H,12,13).
What are the key properties of 2-(2-fluoroethoxy)-N-hexylacetamide?
2-(2-fluoroethoxy)-N-hexylacetamide has a molecular weight of 205.27 g/mol, XLogP of 1.67, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoroethoxy)-N-hexylacetamide is sourced from PubChem (CID 177213455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).