2-fluoroethyl N-(2-methoxyethyl)-N-methylcarbamate

C7H14FNO3 — CID 87169653

IUPAC2-fluoroethyl N-(2-methoxyethyl)-N-methylcarbamate
SMILESCOCCN(C)C(=O)OCCF
InChIInChI=1S/C7H14FNO3/c1-9(4-6-11-2)7(10)12-5-3-8/h3-6H2,1-2H3
InChIKeyCESRQARUSNXLME-UHFFFAOYSA-N
MW179.19 g/mol
LogP0.67
Rot. Bonds5

About 2-fluoroethyl N-(2-methoxyethyl)-N-methylcarbamate

2-fluoroethyl N-(2-methoxyethyl)-N-methylcarbamate (PubChem CID 87169653) has the molecular formula C7H14FNO3 and a molecular weight of 179.19 g/mol. Its IUPAC name is 2-fluoroethyl N-(2-methoxyethyl)-N-methylcarbamate.

Molecular Properties

Compound Name2-fluoroethyl N-(2-methoxyethyl)-N-methylcarbamate
PubChem CID87169653
Molecular FormulaC7H14FNO3
Molecular Weight179.19 g/mol
Exact Mass179.10
IUPAC Name2-fluoroethyl N-(2-methoxyethyl)-N-methylcarbamate
SMILESCOCCN(C)C(=O)OCCF
InChIInChI=1S/C7H14FNO3/c1-9(4-6-11-2)7(10)12-5-3-8/h3-6H2,1-2H3
InChIKeyCESRQARUSNXLME-UHFFFAOYSA-N
XLogP0.67
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.19
LogP ≤ 50.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-fluoroethyl N-(2-methoxyethyl)-N-methylcarbamate 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

2-(Dimethylamino)ethyl dimethylcarbamate
CID 15114748
methyl N-(2-methoxyethyl)-N-methylcarbamate
CID 87169869
2-fluoroethyl N,N-diethylcarbamate
CID 88979858
Carbamic acid, ethylmethyl-, ethyl ester
CID 20062878
(5S)-5-fluoro-3-methyl-1,3-oxazolidin-2-one
CID 178338345
4,5-Difluoro-3-methyl-1,3-oxazolidin-2-one
CID 11535571
ethyl N-methyl-N-(2,2,2-trifluoroethyl)carbamate
CID 60762863
2,2,2-trifluoroethyl N-(2-methoxyethyl)-N-methylcarbamate
CID 61068007
2,2,2-trifluoroethyl N-ethyl-N-(2-methoxyethyl)carbamate
CID 61382655
2,2,2-trifluoroethyl N-ethyl-N-methylcarbamate
CID 62734680
4-(Fluoromethyl)-3-methyl-1,3-oxazolidin-2-one
CID 67255510
3-(Fluoromethyl)-1,3-oxazolidin-2-one
CID 67519298

Frequently Asked Questions

What is the IUPAC name of 2-fluoroethyl N-(2-methoxyethyl)-N-methylcarbamate?
The IUPAC name of 2-fluoroethyl N-(2-methoxyethyl)-N-methylcarbamate (CID 87169653) is 2-fluoroethyl N-(2-methoxyethyl)-N-methylcarbamate.
What is the SMILES notation for 2-fluoroethyl N-(2-methoxyethyl)-N-methylcarbamate?
The canonical SMILES for 2-fluoroethyl N-(2-methoxyethyl)-N-methylcarbamate is COCCN(C)C(=O)OCCF.
What is the InChIKey of 2-fluoroethyl N-(2-methoxyethyl)-N-methylcarbamate?
The InChIKey is CESRQARUSNXLME-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14FNO3/c1-9(4-6-11-2)7(10)12-5-3-8/h3-6H2,1-2H3.
What are the key properties of 2-fluoroethyl N-(2-methoxyethyl)-N-methylcarbamate?
2-fluoroethyl N-(2-methoxyethyl)-N-methylcarbamate has a molecular weight of 179.19 g/mol, XLogP of 0.67, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoroethyl N-(2-methoxyethyl)-N-methylcarbamate is sourced from PubChem (CID 87169653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).