2-fluoroethyl N,N-dimethylcarbamate

C5H10FNO2 — CID 89344688

IUPAC2-fluoroethyl N,N-dimethylcarbamate
SMILESCN(C)C(=O)OCCF
InChIInChI=1S/C5H10FNO2/c1-7(2)5(8)9-4-3-6/h3-4H2,1-2H3
InChIKeySOTDAAAIWGTCNW-UHFFFAOYSA-N
MW135.14 g/mol
LogP0.65
Rot. Bonds2

About 2-fluoroethyl N,N-dimethylcarbamate

2-fluoroethyl N,N-dimethylcarbamate (PubChem CID 89344688) has the molecular formula C5H10FNO2 and a molecular weight of 135.14 g/mol. Its IUPAC name is 2-fluoroethyl N,N-dimethylcarbamate.

Molecular Properties

Compound Name2-fluoroethyl N,N-dimethylcarbamate
PubChem CID89344688
Molecular FormulaC5H10FNO2
Molecular Weight135.14 g/mol
Exact Mass135.07
IUPAC Name2-fluoroethyl N,N-dimethylcarbamate
SMILESCN(C)C(=O)OCCF
InChIInChI=1S/C5H10FNO2/c1-7(2)5(8)9-4-3-6/h3-4H2,1-2H3
InChIKeySOTDAAAIWGTCNW-UHFFFAOYSA-N
XLogP0.65
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.14
LogP ≤ 50.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-fluoroethyl N,N-dimethylcarbamate with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-fluoroethyl N,N-dimethylcarbamate?
The IUPAC name of 2-fluoroethyl N,N-dimethylcarbamate (CID 89344688) is 2-fluoroethyl N,N-dimethylcarbamate.
What is the SMILES notation for 2-fluoroethyl N,N-dimethylcarbamate?
The canonical SMILES for 2-fluoroethyl N,N-dimethylcarbamate is CN(C)C(=O)OCCF.
What is the InChIKey of 2-fluoroethyl N,N-dimethylcarbamate?
The InChIKey is SOTDAAAIWGTCNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10FNO2/c1-7(2)5(8)9-4-3-6/h3-4H2,1-2H3.
What are the key properties of 2-fluoroethyl N,N-dimethylcarbamate?
2-fluoroethyl N,N-dimethylcarbamate has a molecular weight of 135.14 g/mol, XLogP of 0.65, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoroethyl N,N-dimethylcarbamate is sourced from PubChem (CID 89344688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).