N-fluorobutanamide

C4H8FNO — CID 19001751

IUPACN-fluorobutanamide
SMILESCCCC(=O)NF
InChIInChI=1S/C4H8FNO/c1-2-3-4(7)6-5/h2-3H2,1H3,(H,6,7)
InChIKeyJPYULMOYFWFSBT-UHFFFAOYSA-N
MW105.11 g/mol
LogP0.79
Rot. Bonds2

About N-fluorobutanamide

N-fluorobutanamide (PubChem CID 19001751) has the molecular formula C4H8FNO and a molecular weight of 105.11 g/mol. Its IUPAC name is N-fluorobutanamide.

Molecular Properties

Compound NameN-fluorobutanamide
PubChem CID19001751
Molecular FormulaC4H8FNO
Molecular Weight105.11 g/mol
Exact Mass105.06
IUPAC NameN-fluorobutanamide
SMILESCCCC(=O)NF
InChIInChI=1S/C4H8FNO/c1-2-3-4(7)6-5/h2-3H2,1H3,(H,6,7)
InChIKeyJPYULMOYFWFSBT-UHFFFAOYSA-N
XLogP0.79
TPSA29.10 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 ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-fluorobutanamide?
The IUPAC name of N-fluorobutanamide (CID 19001751) is N-fluorobutanamide.
What is the SMILES notation for N-fluorobutanamide?
The canonical SMILES for N-fluorobutanamide is CCCC(=O)NF.
What is the InChIKey of N-fluorobutanamide?
The InChIKey is JPYULMOYFWFSBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8FNO/c1-2-3-4(7)6-5/h2-3H2,1H3,(H,6,7).
What are the key properties of N-fluorobutanamide?
N-fluorobutanamide has a molecular weight of 105.11 g/mol, XLogP of 0.79, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-fluorobutanamide is sourced from PubChem (CID 19001751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).