2-fluorobutanamide

C4H8FNO — CID 18322417

IUPAC2-fluorobutanamide
SMILESCCC(F)C(N)=O
InChIInChI=1S/C4H8FNO/c1-2-3(5)4(6)7/h3H,2H2,1H3,(H2,6,7)
InChIKeyMBSCQUPUVUXCQM-UHFFFAOYSA-N
MW105.11 g/mol
LogP0.22
Rot. Bonds2

About 2-fluorobutanamide

2-fluorobutanamide (PubChem CID 18322417) has the molecular formula C4H8FNO and a molecular weight of 105.11 g/mol. Its IUPAC name is 2-fluorobutanamide.

Molecular Properties

Compound Name2-fluorobutanamide
PubChem CID18322417
Molecular FormulaC4H8FNO
Molecular Weight105.11 g/mol
Exact Mass105.06
IUPAC Name2-fluorobutanamide
SMILESCCC(F)C(N)=O
InChIInChI=1S/C4H8FNO/c1-2-3(5)4(6)7/h3H,2H2,1H3,(H2,6,7)
InChIKeyMBSCQUPUVUXCQM-UHFFFAOYSA-N
XLogP0.22
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500105.11
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-fluorobutanamide?
The IUPAC name of 2-fluorobutanamide (CID 18322417) is 2-fluorobutanamide.
What is the SMILES notation for 2-fluorobutanamide?
The canonical SMILES for 2-fluorobutanamide is CCC(F)C(N)=O.
What is the InChIKey of 2-fluorobutanamide?
The InChIKey is MBSCQUPUVUXCQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8FNO/c1-2-3(5)4(6)7/h3H,2H2,1H3,(H2,6,7).
What are the key properties of 2-fluorobutanamide?
2-fluorobutanamide has a molecular weight of 105.11 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-fluorobutanamide is sourced from PubChem (CID 18322417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).