2-fluoroethyl N-ethylcarbamate

C5H10FNO2 — CID 55286725

IUPAC2-fluoroethyl N-ethylcarbamate
SMILESCCNC(=O)OCCF
InChIInChI=1S/C5H10FNO2/c1-2-7-5(8)9-4-3-6/h2-4H2,1H3,(H,7,8)
InChIKeySFQGYTIOZWNZSI-UHFFFAOYSA-N
MW135.14 g/mol
LogP0.70
Rot. Bonds3

About 2-fluoroethyl N-ethylcarbamate

2-fluoroethyl N-ethylcarbamate (PubChem CID 55286725) has the molecular formula C5H10FNO2 and a molecular weight of 135.14 g/mol. Its IUPAC name is 2-fluoroethyl N-ethylcarbamate.

Molecular Properties

Compound Name2-fluoroethyl N-ethylcarbamate
PubChem CID55286725
Molecular FormulaC5H10FNO2
Molecular Weight135.14 g/mol
Exact Mass135.07
IUPAC Name2-fluoroethyl N-ethylcarbamate
SMILESCCNC(=O)OCCF
InChIInChI=1S/C5H10FNO2/c1-2-7-5(8)9-4-3-6/h2-4H2,1H3,(H,7,8)
InChIKeySFQGYTIOZWNZSI-UHFFFAOYSA-N
XLogP0.70
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.14
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-fluoroethyl N-ethylcarbamate?
The IUPAC name of 2-fluoroethyl N-ethylcarbamate (CID 55286725) is 2-fluoroethyl N-ethylcarbamate.
What is the SMILES notation for 2-fluoroethyl N-ethylcarbamate?
The canonical SMILES for 2-fluoroethyl N-ethylcarbamate is CCNC(=O)OCCF.
What is the InChIKey of 2-fluoroethyl N-ethylcarbamate?
The InChIKey is SFQGYTIOZWNZSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10FNO2/c1-2-7-5(8)9-4-3-6/h2-4H2,1H3,(H,7,8).
What are the key properties of 2-fluoroethyl N-ethylcarbamate?
2-fluoroethyl N-ethylcarbamate has a molecular weight of 135.14 g/mol, XLogP of 0.70, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoroethyl N-ethylcarbamate is sourced from PubChem (CID 55286725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).