2-hydroxyethyl N-(2,3-dimethylphenyl)carbamate

C11H15NO3 — CID 79345225

IUPAC2-hydroxyethyl N-(2,3-dimethylphenyl)carbamate
SMILESCc1cccc(NC(=O)OCCO)c1C
InChIInChI=1S/C11H15NO3/c1-8-4-3-5-10(9(8)2)12-11(14)15-7-6-13/h3-5,13H,6-7H2,1-2H3,(H,12,14)
InChIKeyAGWCLNPUKPHWRO-UHFFFAOYSA-N
MW209.24 g/mol
LogP1.84
Rot. Bonds3

About 2-hydroxyethyl N-(2,3-dimethylphenyl)carbamate

2-hydroxyethyl N-(2,3-dimethylphenyl)carbamate (PubChem CID 79345225) has the molecular formula C11H15NO3 and a molecular weight of 209.24 g/mol. Its IUPAC name is 2-hydroxyethyl N-(2,3-dimethylphenyl)carbamate.

Molecular Properties

Compound Name2-hydroxyethyl N-(2,3-dimethylphenyl)carbamate
PubChem CID79345225
Molecular FormulaC11H15NO3
Molecular Weight209.24 g/mol
Exact Mass209.11
IUPAC Name2-hydroxyethyl N-(2,3-dimethylphenyl)carbamate
SMILESCc1cccc(NC(=O)OCCO)c1C
InChIInChI=1S/C11H15NO3/c1-8-4-3-5-10(9(8)2)12-11(14)15-7-6-13/h3-5,13H,6-7H2,1-2H3,(H,12,14)
InChIKeyAGWCLNPUKPHWRO-UHFFFAOYSA-N
XLogP1.84
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.24
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxyethyl N-(2,3-dimethylphenyl)carbamate?
The IUPAC name of 2-hydroxyethyl N-(2,3-dimethylphenyl)carbamate (CID 79345225) is 2-hydroxyethyl N-(2,3-dimethylphenyl)carbamate.
What is the SMILES notation for 2-hydroxyethyl N-(2,3-dimethylphenyl)carbamate?
The canonical SMILES for 2-hydroxyethyl N-(2,3-dimethylphenyl)carbamate is Cc1cccc(NC(=O)OCCO)c1C.
What is the InChIKey of 2-hydroxyethyl N-(2,3-dimethylphenyl)carbamate?
The InChIKey is AGWCLNPUKPHWRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO3/c1-8-4-3-5-10(9(8)2)12-11(14)15-7-6-13/h3-5,13H,6-7H2,1-2H3,(H,12,14).
What are the key properties of 2-hydroxyethyl N-(2,3-dimethylphenyl)carbamate?
2-hydroxyethyl N-(2,3-dimethylphenyl)carbamate has a molecular weight of 209.24 g/mol, XLogP of 1.84, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxyethyl N-(2,3-dimethylphenyl)carbamate is sourced from PubChem (CID 79345225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).