(2-fluorophenyl)methyl N-methylcarbamate

C9H10FNO2 — CID 20688822

IUPAC(2-fluorophenyl)methyl N-methylcarbamate
SMILESCNC(=O)OCc1ccccc1F
InChIInChI=1S/C9H10FNO2/c1-11-9(12)13-6-7-4-2-3-5-8(7)10/h2-5H,6H2,1H3,(H,11,12)
InChIKeyTVAMYQIBFTVANZ-UHFFFAOYSA-N
MW183.18 g/mol
LogP1.68
Rot. Bonds2

About (2-fluorophenyl)methyl N-methylcarbamate

(2-fluorophenyl)methyl N-methylcarbamate (PubChem CID 20688822) has the molecular formula C9H10FNO2 and a molecular weight of 183.18 g/mol. Its IUPAC name is (2-fluorophenyl)methyl N-methylcarbamate.

Molecular Properties

Compound Name(2-fluorophenyl)methyl N-methylcarbamate
PubChem CID20688822
Molecular FormulaC9H10FNO2
Molecular Weight183.18 g/mol
Exact Mass183.07
IUPAC Name(2-fluorophenyl)methyl N-methylcarbamate
SMILESCNC(=O)OCc1ccccc1F
InChIInChI=1S/C9H10FNO2/c1-11-9(12)13-6-7-4-2-3-5-8(7)10/h2-5H,6H2,1H3,(H,11,12)
InChIKeyTVAMYQIBFTVANZ-UHFFFAOYSA-N
XLogP1.68
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 ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-fluorophenyl)methyl N-methylcarbamate?
The IUPAC name of (2-fluorophenyl)methyl N-methylcarbamate (CID 20688822) is (2-fluorophenyl)methyl N-methylcarbamate.
What is the SMILES notation for (2-fluorophenyl)methyl N-methylcarbamate?
The canonical SMILES for (2-fluorophenyl)methyl N-methylcarbamate is CNC(=O)OCc1ccccc1F.
What is the InChIKey of (2-fluorophenyl)methyl N-methylcarbamate?
The InChIKey is TVAMYQIBFTVANZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FNO2/c1-11-9(12)13-6-7-4-2-3-5-8(7)10/h2-5H,6H2,1H3,(H,11,12).
What are the key properties of (2-fluorophenyl)methyl N-methylcarbamate?
(2-fluorophenyl)methyl N-methylcarbamate has a molecular weight of 183.18 g/mol, XLogP of 1.68, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluorophenyl)methyl N-methylcarbamate is sourced from PubChem (CID 20688822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).