(4-ethoxyphenyl) N-methylcarbamate

C10H13NO3 — CID 10081362

IUPAC(4-ethoxyphenyl) N-methylcarbamate
SMILESCCOc1ccc(OC(=O)NC)cc1
InChIInChI=1S/C10H13NO3/c1-3-13-8-4-6-9(7-5-8)14-10(12)11-2/h4-7H,3H2,1-2H3,(H,11,12)
InChIKeyDBWSPRINULFTMC-UHFFFAOYSA-N
MW195.22 g/mol
LogP1.80
Rot. Bonds3

About (4-ethoxyphenyl) N-methylcarbamate

(4-ethoxyphenyl) N-methylcarbamate (PubChem CID 10081362) has the molecular formula C10H13NO3 and a molecular weight of 195.22 g/mol. Its IUPAC name is (4-ethoxyphenyl) N-methylcarbamate.

Molecular Properties

Compound Name(4-ethoxyphenyl) N-methylcarbamate
PubChem CID10081362
Molecular FormulaC10H13NO3
Molecular Weight195.22 g/mol
Exact Mass195.09
IUPAC Name(4-ethoxyphenyl) N-methylcarbamate
SMILESCCOc1ccc(OC(=O)NC)cc1
InChIInChI=1S/C10H13NO3/c1-3-13-8-4-6-9(7-5-8)14-10(12)11-2/h4-7H,3H2,1-2H3,(H,11,12)
InChIKeyDBWSPRINULFTMC-UHFFFAOYSA-N
XLogP1.80
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4-ethoxyphenyl) N-methylcarbamate?
The IUPAC name of (4-ethoxyphenyl) N-methylcarbamate (CID 10081362) is (4-ethoxyphenyl) N-methylcarbamate.
What is the SMILES notation for (4-ethoxyphenyl) N-methylcarbamate?
The canonical SMILES for (4-ethoxyphenyl) N-methylcarbamate is CCOc1ccc(OC(=O)NC)cc1.
What is the InChIKey of (4-ethoxyphenyl) N-methylcarbamate?
The InChIKey is DBWSPRINULFTMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO3/c1-3-13-8-4-6-9(7-5-8)14-10(12)11-2/h4-7H,3H2,1-2H3,(H,11,12).
What are the key properties of (4-ethoxyphenyl) N-methylcarbamate?
(4-ethoxyphenyl) N-methylcarbamate has a molecular weight of 195.22 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethoxyphenyl) N-methylcarbamate is sourced from PubChem (CID 10081362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).