(4-acetamidophenyl) N,N-dimethylcarbamate

C11H14N2O3 — CID 656203

IUPAC(4-acetamidophenyl) N,N-dimethylcarbamate
SMILESCC(=O)Nc1ccc(OC(=O)N(C)C)cc1
InChIInChI=1S/C11H14N2O3/c1-8(14)12-9-4-6-10(7-5-9)16-11(15)13(2)3/h4-7H,1-3H3,(H,12,14)
InChIKeyUAIMULSXTPBYPA-UHFFFAOYSA-N
MW222.24 g/mol
LogP1.71
Rot. Bonds2

About (4-acetamidophenyl) N,N-dimethylcarbamate

(4-acetamidophenyl) N,N-dimethylcarbamate (PubChem CID 656203) has the molecular formula C11H14N2O3 and a molecular weight of 222.24 g/mol. Its IUPAC name is (4-acetamidophenyl) N,N-dimethylcarbamate.

Molecular Properties

Compound Name(4-acetamidophenyl) N,N-dimethylcarbamate
PubChem CID656203
Molecular FormulaC11H14N2O3
Molecular Weight222.24 g/mol
Exact Mass222.10
IUPAC Name(4-acetamidophenyl) N,N-dimethylcarbamate
SMILESCC(=O)Nc1ccc(OC(=O)N(C)C)cc1
InChIInChI=1S/C11H14N2O3/c1-8(14)12-9-4-6-10(7-5-9)16-11(15)13(2)3/h4-7H,1-3H3,(H,12,14)
InChIKeyUAIMULSXTPBYPA-UHFFFAOYSA-N
XLogP1.71
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.24
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4-acetamidophenyl) N,N-dimethylcarbamate?
The IUPAC name of (4-acetamidophenyl) N,N-dimethylcarbamate (CID 656203) is (4-acetamidophenyl) N,N-dimethylcarbamate.
What is the SMILES notation for (4-acetamidophenyl) N,N-dimethylcarbamate?
The canonical SMILES for (4-acetamidophenyl) N,N-dimethylcarbamate is CC(=O)Nc1ccc(OC(=O)N(C)C)cc1.
What is the InChIKey of (4-acetamidophenyl) N,N-dimethylcarbamate?
The InChIKey is UAIMULSXTPBYPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O3/c1-8(14)12-9-4-6-10(7-5-9)16-11(15)13(2)3/h4-7H,1-3H3,(H,12,14).
What are the key properties of (4-acetamidophenyl) N,N-dimethylcarbamate?
(4-acetamidophenyl) N,N-dimethylcarbamate has a molecular weight of 222.24 g/mol, XLogP of 1.71, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-acetamidophenyl) N,N-dimethylcarbamate is sourced from PubChem (CID 656203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).