N-ethyl-N-methylcarbamoyl fluoride

C4H8FNO — CID 174277337

IUPACN-ethyl-N-methylcarbamoyl fluoride
SMILESCCN(C)C(=O)F
InChIInChI=1S/C4H8FNO/c1-3-6(2)4(5)7/h3H2,1-2H3
InChIKeyGVTIBEYROQTISE-UHFFFAOYSA-N
MW105.11 g/mol
LogP1.03
Rot. Bonds1

About N-ethyl-N-methylcarbamoyl fluoride

N-ethyl-N-methylcarbamoyl fluoride (PubChem CID 174277337) has the molecular formula C4H8FNO and a molecular weight of 105.11 g/mol. Its IUPAC name is N-ethyl-N-methylcarbamoyl fluoride.

Molecular Properties

Compound NameN-ethyl-N-methylcarbamoyl fluoride
PubChem CID174277337
Molecular FormulaC4H8FNO
Molecular Weight105.11 g/mol
Exact Mass105.06
IUPAC NameN-ethyl-N-methylcarbamoyl fluoride
SMILESCCN(C)C(=O)F
InChIInChI=1S/C4H8FNO/c1-3-6(2)4(5)7/h3H2,1-2H3
InChIKeyGVTIBEYROQTISE-UHFFFAOYSA-N
XLogP1.03
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500105.11
LogP ≤ 51.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-ethyl-N-methylcarbamoyl fluoride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Acetamide, N,N-diethyl-alpha-fluoro-
CID 9699
Diethylcarbamoyl fluoride
CID 12750942
N,N-di(propan-2-yl)carbamoyl fluoride
CID 135080715
Diethylaminomethanone
CID 59896870
N-methyl-N-propylcarbamoyl fluoride
CID 18737102
N-(fluoromethyl)-N-propan-2-ylcarbamoyl fluoride
CID 54081738
N-(dimethylaminosulfanyl)-N-ethylcarbamoyl fluoride
CID 54505631
N-ethyl-N-[fluoro(methoxy)methyl]formamide
CID 56626610
CID 59886665
CID 59886665
N-(2-fluoroethyl)-N-methylacetamide
CID 60142866
N-(2-fluoroethyl)-N-methylformamide
CID 87078395
N-ethyl-N-(fluoromethyl)carbamoyl fluoride
CID 89093586

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methylcarbamoyl fluoride?
The IUPAC name of N-ethyl-N-methylcarbamoyl fluoride (CID 174277337) is N-ethyl-N-methylcarbamoyl fluoride.
What is the SMILES notation for N-ethyl-N-methylcarbamoyl fluoride?
The canonical SMILES for N-ethyl-N-methylcarbamoyl fluoride is CCN(C)C(=O)F.
What is the InChIKey of N-ethyl-N-methylcarbamoyl fluoride?
The InChIKey is GVTIBEYROQTISE-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8FNO/c1-3-6(2)4(5)7/h3H2,1-2H3.
What are the key properties of N-ethyl-N-methylcarbamoyl fluoride?
N-ethyl-N-methylcarbamoyl fluoride has a molecular weight of 105.11 g/mol, XLogP of 1.03, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methylcarbamoyl fluoride is sourced from PubChem (CID 174277337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).