N-(fluoromethyl)acetamide

C3H6FNO — CID 90974509

IUPACN-(fluoromethyl)acetamide
SMILESCC(=O)NCF
InChIInChI=1S/C3H6FNO/c1-3(6)5-2-4/h2H2,1H3,(H,5,6)
InChIKeyMDFXPGSKXOBNPJ-UHFFFAOYSA-N
MW91.08 g/mol
LogP0.05
Rot. Bonds1

About N-(fluoromethyl)acetamide

N-(fluoromethyl)acetamide (PubChem CID 90974509) has the molecular formula C3H6FNO and a molecular weight of 91.08 g/mol. Its IUPAC name is N-(fluoromethyl)acetamide.

Molecular Properties

Compound NameN-(fluoromethyl)acetamide
PubChem CID90974509
Molecular FormulaC3H6FNO
Molecular Weight91.08 g/mol
Exact Mass91.04
IUPAC NameN-(fluoromethyl)acetamide
SMILESCC(=O)NCF
InChIInChI=1S/C3H6FNO/c1-3(6)5-2-4/h2H2,1H3,(H,5,6)
InChIKeyMDFXPGSKXOBNPJ-UHFFFAOYSA-N
XLogP0.05
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50091.08
LogP ≤ 50.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

acetamidomethylphosphonic acid
CID 3017080
N-(2,2,2-trifluoroethyl)acetamide
CID 23168969
CID 88764909
CID 88764909
N-(bromomethyl)acetamide
CID 22970413
N-ethylacetamide;hydrochloride
CID 87177071
N-(3-acetamidopropyl)acetamide
CID 5147555
N-[2-(diacetylamino)ethyl]acetamide
CID 536138
2-acetamidoethyl 2-fluoroacetate
CID 45254008
N-(3-acetamido-2-methylpropyl)acetamide
CID 20588188
N-(2,2-difluorobutyl)acetamide
CID 88583149
bis(2-acetamidoacetic acid);copper;trihydrate
CID 57404078
3-acetamidopropanoyloxidanium
CID 154009858

Frequently Asked Questions

What is the IUPAC name of N-(fluoromethyl)acetamide?
The IUPAC name of N-(fluoromethyl)acetamide (CID 90974509) is N-(fluoromethyl)acetamide.
What is the SMILES notation for N-(fluoromethyl)acetamide?
The canonical SMILES for N-(fluoromethyl)acetamide is CC(=O)NCF.
What is the InChIKey of N-(fluoromethyl)acetamide?
The InChIKey is MDFXPGSKXOBNPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6FNO/c1-3(6)5-2-4/h2H2,1H3,(H,5,6).
What are the key properties of N-(fluoromethyl)acetamide?
N-(fluoromethyl)acetamide has a molecular weight of 91.08 g/mol, XLogP of 0.05, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(fluoromethyl)acetamide is sourced from PubChem (CID 90974509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).