propan-2-yl N-methyl-N-phenylcarbamate

C11H15NO2 — CID 18691

IUPACpropan-2-yl N-methyl-N-phenylcarbamate
SMILESCC(C)OC(=O)N(C)c1ccccc1
InChIInChI=1S/C11H15NO2/c1-9(2)14-11(13)12(3)10-7-5-4-6-8-10/h4-9H,1-3H3
InChIKeyOGQJEQNWJVFSGO-UHFFFAOYSA-N
MW193.25 g/mol
LogP2.67
Rot. Bonds2

About propan-2-yl N-methyl-N-phenylcarbamate

propan-2-yl N-methyl-N-phenylcarbamate (PubChem CID 18691) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is propan-2-yl N-methyl-N-phenylcarbamate.

Molecular Properties

Compound Namepropan-2-yl N-methyl-N-phenylcarbamate
PubChem CID18691
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Namepropan-2-yl N-methyl-N-phenylcarbamate
SMILESCC(C)OC(=O)N(C)c1ccccc1
InChIInChI=1S/C11H15NO2/c1-9(2)14-11(13)12(3)10-7-5-4-6-8-10/h4-9H,1-3H3
InChIKeyOGQJEQNWJVFSGO-UHFFFAOYSA-N
XLogP2.67
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of propan-2-yl N-methyl-N-phenylcarbamate?
The IUPAC name of propan-2-yl N-methyl-N-phenylcarbamate (CID 18691) is propan-2-yl N-methyl-N-phenylcarbamate.
What is the SMILES notation for propan-2-yl N-methyl-N-phenylcarbamate?
The canonical SMILES for propan-2-yl N-methyl-N-phenylcarbamate is CC(C)OC(=O)N(C)c1ccccc1.
What is the InChIKey of propan-2-yl N-methyl-N-phenylcarbamate?
The InChIKey is OGQJEQNWJVFSGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-9(2)14-11(13)12(3)10-7-5-4-6-8-10/h4-9H,1-3H3.
What are the key properties of propan-2-yl N-methyl-N-phenylcarbamate?
propan-2-yl N-methyl-N-phenylcarbamate has a molecular weight of 193.25 g/mol, XLogP of 2.67, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yl N-methyl-N-phenylcarbamate is sourced from PubChem (CID 18691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).