2-fluoroethyl N,N-diethylcarbamate

C7H14FNO2 — CID 88979858

IUPAC2-fluoroethyl N,N-diethylcarbamate
SMILESCCN(CC)C(=O)OCCF
InChIInChI=1S/C7H14FNO2/c1-3-9(4-2)7(10)11-6-5-8/h3-6H2,1-2H3
InChIKeyHPIHHJLSRSRUFE-UHFFFAOYSA-N
MW163.19 g/mol
LogP1.43
Rot. Bonds4

About 2-fluoroethyl N,N-diethylcarbamate

2-fluoroethyl N,N-diethylcarbamate (PubChem CID 88979858) has the molecular formula C7H14FNO2 and a molecular weight of 163.19 g/mol. Its IUPAC name is 2-fluoroethyl N,N-diethylcarbamate.

Molecular Properties

Compound Name2-fluoroethyl N,N-diethylcarbamate
PubChem CID88979858
Molecular FormulaC7H14FNO2
Molecular Weight163.19 g/mol
Exact Mass163.10
IUPAC Name2-fluoroethyl N,N-diethylcarbamate
SMILESCCN(CC)C(=O)OCCF
InChIInChI=1S/C7H14FNO2/c1-3-9(4-2)7(10)11-6-5-8/h3-6H2,1-2H3
InChIKeyHPIHHJLSRSRUFE-UHFFFAOYSA-N
XLogP1.43
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.19
LogP ≤ 51.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Ethyl diethylcarbamate
CID 19083
Carbamic acid, diethyl-, 2,2,2-trifluoroethyl ester
CID 10965508
2-Fluoroethyl N,N-dimethylcarbamate
CID 89344688
Carbamic acid, ethylmethyl-, ethyl ester
CID 20062878
2-fluoroethyl N,N-dipropylcarbamate
CID 129671671
Methylpropylurethan
CID 62048192
methyl N-fluoro-N-(1-methoxyethyl)carbamate
CID 23050912
ethyl N-methyl-N-(2,2,2-trifluoroethyl)carbamate
CID 60762863
2,2,2-trifluoroethyl N-ethyl-N-methylcarbamate
CID 62734680
fluoromethyl N,N-diethylcarbamate
CID 86664946
2-fluoroethyl N-(2-methoxyethyl)-N-methylcarbamate
CID 87169653
2,2,2-trifluoroethyl N-ethyl-N-(methoxymethyl)carbamate
CID 87169675

Frequently Asked Questions

What is the IUPAC name of 2-fluoroethyl N,N-diethylcarbamate?
The IUPAC name of 2-fluoroethyl N,N-diethylcarbamate (CID 88979858) is 2-fluoroethyl N,N-diethylcarbamate.
What is the SMILES notation for 2-fluoroethyl N,N-diethylcarbamate?
The canonical SMILES for 2-fluoroethyl N,N-diethylcarbamate is CCN(CC)C(=O)OCCF.
What is the InChIKey of 2-fluoroethyl N,N-diethylcarbamate?
The InChIKey is HPIHHJLSRSRUFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14FNO2/c1-3-9(4-2)7(10)11-6-5-8/h3-6H2,1-2H3.
What are the key properties of 2-fluoroethyl N,N-diethylcarbamate?
2-fluoroethyl N,N-diethylcarbamate has a molecular weight of 163.19 g/mol, XLogP of 1.43, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoroethyl N,N-diethylcarbamate is sourced from PubChem (CID 88979858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).