1-(2-fluorophenyl)ethyl carbamate

C9H10FNO2 — CID 66709587

IUPAC1-(2-fluorophenyl)ethyl carbamate
SMILESCC(OC(N)=O)c1ccccc1F
InChIInChI=1S/C9H10FNO2/c1-6(13-9(11)12)7-4-2-3-5-8(7)10/h2-6H,1H3,(H2,11,12)
InChIKeyZWURUNVECRTCFK-UHFFFAOYSA-N
MW183.18 g/mol
LogP1.98
Rot. Bonds2

About 1-(2-fluorophenyl)ethyl carbamate

1-(2-fluorophenyl)ethyl carbamate (PubChem CID 66709587) has the molecular formula C9H10FNO2 and a molecular weight of 183.18 g/mol. Its IUPAC name is 1-(2-fluorophenyl)ethyl carbamate.

Molecular Properties

Compound Name1-(2-fluorophenyl)ethyl carbamate
PubChem CID66709587
Molecular FormulaC9H10FNO2
Molecular Weight183.18 g/mol
Exact Mass183.07
IUPAC Name1-(2-fluorophenyl)ethyl carbamate
SMILESCC(OC(N)=O)c1ccccc1F
InChIInChI=1S/C9H10FNO2/c1-6(13-9(11)12)7-4-2-3-5-8(7)10/h2-6H,1H3,(H2,11,12)
InChIKeyZWURUNVECRTCFK-UHFFFAOYSA-N
XLogP1.98
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.18
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)ethyl carbamate?
The IUPAC name of 1-(2-fluorophenyl)ethyl carbamate (CID 66709587) is 1-(2-fluorophenyl)ethyl carbamate.
What is the SMILES notation for 1-(2-fluorophenyl)ethyl carbamate?
The canonical SMILES for 1-(2-fluorophenyl)ethyl carbamate is CC(OC(N)=O)c1ccccc1F.
What is the InChIKey of 1-(2-fluorophenyl)ethyl carbamate?
The InChIKey is ZWURUNVECRTCFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FNO2/c1-6(13-9(11)12)7-4-2-3-5-8(7)10/h2-6H,1H3,(H2,11,12).
What are the key properties of 1-(2-fluorophenyl)ethyl carbamate?
1-(2-fluorophenyl)ethyl carbamate has a molecular weight of 183.18 g/mol, XLogP of 1.98, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)ethyl carbamate is sourced from PubChem (CID 66709587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).