(2-fluorophenyl) N-ethylcarbamate

C9H10FNO2 — CID 127543525

IUPAC(2-fluorophenyl) N-ethylcarbamate
SMILESCCNC(=O)Oc1ccccc1F
InChIInChI=1S/C9H10FNO2/c1-2-11-9(12)13-8-6-4-3-5-7(8)10/h3-6H,2H2,1H3,(H,11,12)
InChIKeyUALKIIHTEAZOMC-UHFFFAOYSA-N
MW183.18 g/mol
LogP1.93
Rot. Bonds2

About (2-fluorophenyl) N-ethylcarbamate

(2-fluorophenyl) N-ethylcarbamate (PubChem CID 127543525) has the molecular formula C9H10FNO2 and a molecular weight of 183.18 g/mol. Its IUPAC name is (2-fluorophenyl) N-ethylcarbamate.

Molecular Properties

Compound Name(2-fluorophenyl) N-ethylcarbamate
PubChem CID127543525
Molecular FormulaC9H10FNO2
Molecular Weight183.18 g/mol
Exact Mass183.07
IUPAC Name(2-fluorophenyl) N-ethylcarbamate
SMILESCCNC(=O)Oc1ccccc1F
InChIInChI=1S/C9H10FNO2/c1-2-11-9(12)13-8-6-4-3-5-7(8)10/h3-6H,2H2,1H3,(H,11,12)
InChIKeyUALKIIHTEAZOMC-UHFFFAOYSA-N
XLogP1.93
TPSA38.33 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 ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2,5-difluorophenyl) N-ethylcarbamate
CID 127549988
(2,3-dimethylphenyl) N-ethylcarbamate
CID 127545689
(2-fluorophenyl) N-ethyl-N-methylcarbamate
CID 171662509
(2-fluorophenyl) N-chlorosulfonylcarbamate
CID 88948321
(2-fluorophenyl) 2-oxopropanoate
CID 54044054
4-O-(2-fluorophenyl) 1-O-(2-propylphenyl) butanedioate
CID 91735547
bis(2-fluorophenyl) hexanedioate
CID 91704928
acetyl acetate;(2-fluorophenyl) acetate
CID 158232558
ethyl (E)-2-bromo-3-(2-fluorophenoxy)but-2-enoate
CID 87195019
(2-fluorophenyl) 2-methylpentanoate
CID 78777060
(2-fluorophenyl) 2-hydroxy-2-methylpropanoate
CID 117051075
4-O-(2,3-dimethylphenyl) 1-O-(2-fluorophenyl) butanedioate
CID 91733507

Frequently Asked Questions

What is the IUPAC name of (2-fluorophenyl) N-ethylcarbamate?
The IUPAC name of (2-fluorophenyl) N-ethylcarbamate (CID 127543525) is (2-fluorophenyl) N-ethylcarbamate.
What is the SMILES notation for (2-fluorophenyl) N-ethylcarbamate?
The canonical SMILES for (2-fluorophenyl) N-ethylcarbamate is CCNC(=O)Oc1ccccc1F.
What is the InChIKey of (2-fluorophenyl) N-ethylcarbamate?
The InChIKey is UALKIIHTEAZOMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FNO2/c1-2-11-9(12)13-8-6-4-3-5-7(8)10/h3-6H,2H2,1H3,(H,11,12).
What are the key properties of (2-fluorophenyl) N-ethylcarbamate?
(2-fluorophenyl) N-ethylcarbamate has a molecular weight of 183.18 g/mol, XLogP of 1.93, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluorophenyl) N-ethylcarbamate is sourced from PubChem (CID 127543525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).