tert-butyl N-(2-fluoroethyl)-N-propylcarbamate

C10H20FNO2 — CID 122600492

IUPACtert-butyl N-(2-fluoroethyl)-N-propylcarbamate
SMILESCCCN(CCF)C(=O)OC(C)(C)C
InChIInChI=1S/C10H20FNO2/c1-5-7-12(8-6-11)9(13)14-10(2,3)4/h5-8H2,1-4H3
InChIKeyURMDJLNZDQKHFF-UHFFFAOYSA-N
MW205.27 g/mol
LogP2.60
Rot. Bonds4

About tert-butyl N-(2-fluoroethyl)-N-propylcarbamate

tert-butyl N-(2-fluoroethyl)-N-propylcarbamate (PubChem CID 122600492) has the molecular formula C10H20FNO2 and a molecular weight of 205.27 g/mol. Its IUPAC name is tert-butyl N-(2-fluoroethyl)-N-propylcarbamate.

Molecular Properties

Compound Nametert-butyl N-(2-fluoroethyl)-N-propylcarbamate
PubChem CID122600492
Molecular FormulaC10H20FNO2
Molecular Weight205.27 g/mol
Exact Mass205.15
IUPAC Nametert-butyl N-(2-fluoroethyl)-N-propylcarbamate
SMILESCCCN(CCF)C(=O)OC(C)(C)C
InChIInChI=1S/C10H20FNO2/c1-5-7-12(8-6-11)9(13)14-10(2,3)4/h5-8H2,1-4H3
InChIKeyURMDJLNZDQKHFF-UHFFFAOYSA-N
XLogP2.60
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.27
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

CID 643455
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CID 55271007
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CID 40430177
CID 40430177
CID 47003388
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CID 25001215
CID 25001215
CID 129157469
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CID 117971374
CID 117971374
CID 129671671
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CID 154707597
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CID 11095337
CID 11095337

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-(2-fluoroethyl)-N-propylcarbamate?
The IUPAC name of tert-butyl N-(2-fluoroethyl)-N-propylcarbamate (CID 122600492) is tert-butyl N-(2-fluoroethyl)-N-propylcarbamate.
What is the SMILES notation for tert-butyl N-(2-fluoroethyl)-N-propylcarbamate?
The canonical SMILES for tert-butyl N-(2-fluoroethyl)-N-propylcarbamate is CCCN(CCF)C(=O)OC(C)(C)C.
What is the InChIKey of tert-butyl N-(2-fluoroethyl)-N-propylcarbamate?
The InChIKey is URMDJLNZDQKHFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20FNO2/c1-5-7-12(8-6-11)9(13)14-10(2,3)4/h5-8H2,1-4H3.
What are the key properties of tert-butyl N-(2-fluoroethyl)-N-propylcarbamate?
tert-butyl N-(2-fluoroethyl)-N-propylcarbamate has a molecular weight of 205.27 g/mol, XLogP of 2.60, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-(2-fluoroethyl)-N-propylcarbamate is sourced from PubChem (CID 122600492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).