2-cyclopropyl-2-fluoroacetamide

C5H8FNO — CID 115011078

IUPAC2-cyclopropyl-2-fluoroacetamide
SMILESNC(=O)C(F)C1CC1
InChIInChI=1S/C5H8FNO/c6-4(5(7)8)3-1-2-3/h3-4H,1-2H2,(H2,7,8)
InChIKeyFGUVXBYTJNKCRG-UHFFFAOYSA-N
MW117.12 g/mol
LogP0.22
Rot. Bonds2

About 2-cyclopropyl-2-fluoroacetamide

2-cyclopropyl-2-fluoroacetamide (PubChem CID 115011078) has the molecular formula C5H8FNO and a molecular weight of 117.12 g/mol. Its IUPAC name is 2-cyclopropyl-2-fluoroacetamide.

Molecular Properties

Compound Name2-cyclopropyl-2-fluoroacetamide
PubChem CID115011078
Molecular FormulaC5H8FNO
Molecular Weight117.12 g/mol
Exact Mass117.06
IUPAC Name2-cyclopropyl-2-fluoroacetamide
SMILESNC(=O)C(F)C1CC1
InChIInChI=1S/C5H8FNO/c6-4(5(7)8)3-1-2-3/h3-4H,1-2H2,(H2,7,8)
InChIKeyFGUVXBYTJNKCRG-UHFFFAOYSA-N
XLogP0.22
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.12
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-fluoroacetamide?
The IUPAC name of 2-cyclopropyl-2-fluoroacetamide (CID 115011078) is 2-cyclopropyl-2-fluoroacetamide.
What is the SMILES notation for 2-cyclopropyl-2-fluoroacetamide?
The canonical SMILES for 2-cyclopropyl-2-fluoroacetamide is NC(=O)C(F)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-fluoroacetamide?
The InChIKey is FGUVXBYTJNKCRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8FNO/c6-4(5(7)8)3-1-2-3/h3-4H,1-2H2,(H2,7,8).
What are the key properties of 2-cyclopropyl-2-fluoroacetamide?
2-cyclopropyl-2-fluoroacetamide has a molecular weight of 117.12 g/mol, XLogP of 0.22, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-fluoroacetamide is sourced from PubChem (CID 115011078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).