methyl N-methyl-N-phenylcarbamate

C9H11NO2 — CID 11744989

IUPACmethyl N-methyl-N-phenylcarbamate
SMILESCOC(=O)N(C)c1ccccc1
InChIInChI=1S/C9H11NO2/c1-10(9(11)12-2)8-6-4-3-5-7-8/h3-7H,1-2H3
InChIKeyYFZJZJIUKMANKN-UHFFFAOYSA-N
MW165.19 g/mol
LogP1.89
Rot. Bonds1

About methyl N-methyl-N-phenylcarbamate

methyl N-methyl-N-phenylcarbamate (PubChem CID 11744989) has the molecular formula C9H11NO2 and a molecular weight of 165.19 g/mol. Its IUPAC name is methyl N-methyl-N-phenylcarbamate.

Molecular Properties

Compound Namemethyl N-methyl-N-phenylcarbamate
PubChem CID11744989
Molecular FormulaC9H11NO2
Molecular Weight165.19 g/mol
Exact Mass165.08
IUPAC Namemethyl N-methyl-N-phenylcarbamate
SMILESCOC(=O)N(C)c1ccccc1
InChIInChI=1S/C9H11NO2/c1-10(9(11)12-2)8-6-4-3-5-7-8/h3-7H,1-2H3
InChIKeyYFZJZJIUKMANKN-UHFFFAOYSA-N
XLogP1.89
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.19
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of methyl N-methyl-N-phenylcarbamate?
The IUPAC name of methyl N-methyl-N-phenylcarbamate (CID 11744989) is methyl N-methyl-N-phenylcarbamate.
What is the SMILES notation for methyl N-methyl-N-phenylcarbamate?
The canonical SMILES for methyl N-methyl-N-phenylcarbamate is COC(=O)N(C)c1ccccc1.
What is the InChIKey of methyl N-methyl-N-phenylcarbamate?
The InChIKey is YFZJZJIUKMANKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO2/c1-10(9(11)12-2)8-6-4-3-5-7-8/h3-7H,1-2H3.
What are the key properties of methyl N-methyl-N-phenylcarbamate?
methyl N-methyl-N-phenylcarbamate has a molecular weight of 165.19 g/mol, XLogP of 1.89, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-methyl-N-phenylcarbamate is sourced from PubChem (CID 11744989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).