ethyl N-[2-(4-hydroxyphenoxy)ethyl]carbamate

C11H15NO4 — CID 14552586

IUPACethyl N-[2-(4-hydroxyphenoxy)ethyl]carbamate
SMILESCCOC(=O)NCCOc1ccc(O)cc1
InChIInChI=1S/C11H15NO4/c1-2-15-11(14)12-7-8-16-10-5-3-9(13)4-6-10/h3-6,13H,2,7-8H2,1H3,(H,12,14)
InChIKeyCVIMQGLSYIUERM-UHFFFAOYSA-N
MW225.24 g/mol
LogP1.52
Rot. Bonds5

About ethyl N-[2-(4-hydroxyphenoxy)ethyl]carbamate

ethyl N-[2-(4-hydroxyphenoxy)ethyl]carbamate (PubChem CID 14552586) has the molecular formula C11H15NO4 and a molecular weight of 225.24 g/mol. Its IUPAC name is ethyl N-[2-(4-hydroxyphenoxy)ethyl]carbamate.

Molecular Properties

Compound Nameethyl N-[2-(4-hydroxyphenoxy)ethyl]carbamate
PubChem CID14552586
Molecular FormulaC11H15NO4
Molecular Weight225.24 g/mol
Exact Mass225.10
IUPAC Nameethyl N-[2-(4-hydroxyphenoxy)ethyl]carbamate
SMILESCCOC(=O)NCCOc1ccc(O)cc1
InChIInChI=1S/C11H15NO4/c1-2-15-11(14)12-7-8-16-10-5-3-9(13)4-6-10/h3-6,13H,2,7-8H2,1H3,(H,12,14)
InChIKeyCVIMQGLSYIUERM-UHFFFAOYSA-N
XLogP1.52
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.24
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

Fenoxycarb
CID 51605
Ethyl-[2-[p-(p-hydroxyphenoxy)phenoxy]ethyl]-carbamate
CID 129829018
4-[4-(2-Aminoethoxy)phenoxy]phenol
CID 139596467
2-hydroxyethyl N-[2-[4-(4-hydroxyphenoxy)phenoxy]ethyl]carbamate
CID 139597061
5-((4-Methoxyphenoxy)methyl)-2-oxazolidinone
CID 650874
N-Methyl-4-ethoxyphenylcarbamate
CID 10081362
N-(phenoxyacetyl)glycine
CID 300109
4-[2-(3-Phenoxy-propylamino)-ethoxy]-phenol
CID 10684706
4-hydroxy-N-[2-(4-methoxyphenoxy)ethyl]butanamide
CID 2811297
N-(2-Phenoxyethyl)Acetamide
CID 12436516
tert-Butyl (2-phenoxyethyl)carbamate
CID 63789556
4-(2-Aminoethoxy)phenol
CID 3016535

Frequently Asked Questions

What is the IUPAC name of ethyl N-[2-(4-hydroxyphenoxy)ethyl]carbamate?
The IUPAC name of ethyl N-[2-(4-hydroxyphenoxy)ethyl]carbamate (CID 14552586) is ethyl N-[2-(4-hydroxyphenoxy)ethyl]carbamate.
What is the SMILES notation for ethyl N-[2-(4-hydroxyphenoxy)ethyl]carbamate?
The canonical SMILES for ethyl N-[2-(4-hydroxyphenoxy)ethyl]carbamate is CCOC(=O)NCCOc1ccc(O)cc1.
What is the InChIKey of ethyl N-[2-(4-hydroxyphenoxy)ethyl]carbamate?
The InChIKey is CVIMQGLSYIUERM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO4/c1-2-15-11(14)12-7-8-16-10-5-3-9(13)4-6-10/h3-6,13H,2,7-8H2,1H3,(H,12,14).
What are the key properties of ethyl N-[2-(4-hydroxyphenoxy)ethyl]carbamate?
ethyl N-[2-(4-hydroxyphenoxy)ethyl]carbamate has a molecular weight of 225.24 g/mol, XLogP of 1.52, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-[2-(4-hydroxyphenoxy)ethyl]carbamate is sourced from PubChem (CID 14552586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).