2-phenoxyethyl N-(3-hydroxyphenyl)carbamate

C15H15NO4 — CID 139715233

IUPAC2-phenoxyethyl N-(3-hydroxyphenyl)carbamate
SMILESO=C(Nc1cccc(O)c1)OCCOc1ccccc1
InChIInChI=1S/C15H15NO4/c17-13-6-4-5-12(11-13)16-15(18)20-10-9-19-14-7-2-1-3-8-14/h1-8,11,17H,9-10H2,(H,16,18)
InChIKeyNLJWHGGGGGDBAT-UHFFFAOYSA-N
MW273.29 g/mol
LogP3.02
Rot. Bonds5

About 2-phenoxyethyl N-(3-hydroxyphenyl)carbamate

2-phenoxyethyl N-(3-hydroxyphenyl)carbamate (PubChem CID 139715233) has the molecular formula C15H15NO4 and a molecular weight of 273.29 g/mol. Its IUPAC name is 2-phenoxyethyl N-(3-hydroxyphenyl)carbamate.

Molecular Properties

Compound Name2-phenoxyethyl N-(3-hydroxyphenyl)carbamate
PubChem CID139715233
Molecular FormulaC15H15NO4
Molecular Weight273.29 g/mol
Exact Mass273.10
IUPAC Name2-phenoxyethyl N-(3-hydroxyphenyl)carbamate
SMILESO=C(Nc1cccc(O)c1)OCCOc1ccccc1
InChIInChI=1S/C15H15NO4/c17-13-6-4-5-12(11-13)16-15(18)20-10-9-19-14-7-2-1-3-8-14/h1-8,11,17H,9-10H2,(H,16,18)
InChIKeyNLJWHGGGGGDBAT-UHFFFAOYSA-N
XLogP3.02
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 53.02
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

2-hydroxyethyl N-(3-hydroxyphenyl)carbamate
CID 79345264
2-[2-(phenylcarbamoyloxy)ethoxy]ethyl N-phenylcarbamate
CID 4644419
2-[(3-methylphenyl)carbamoyloxy]ethyl N-(3-methylphenyl)carbamate
CID 176596945
ethyl N-(3-propoxyphenyl)carbamate
CID 60643143
N-(3-hydroxyphenyl)-2-(4-propoxyphenoxy)acetamide
CID 78783405
3-(2-aminophenyl)-N-[3-(2-phenoxyethoxy)phenyl]propanamide
CID 54795447
2-phenylethyl 4-oxo-4-[3-(2-phenoxyethoxy)anilino]butanoate
CID 17123549
methylcarbamic acid;prop-2-ynyl N-(3-hydroxyphenyl)carbamate
CID 23619616
2-(2-chlorophenoxy)ethyl N-(3-chlorophenyl)carbamate
CID 2244784
methylcarbamic acid;methyl N-(3-hydroxyphenyl)carbamate
CID 23619088
4-(2-phenoxyethoxy)-N-(3-phenylmethoxyphenyl)benzamide
CID 17086099
2,2,2-trifluoroethyl N-[3-(2-methoxyethoxy)phenyl]carbamate
CID 65173322

Frequently Asked Questions

What is the IUPAC name of 2-phenoxyethyl N-(3-hydroxyphenyl)carbamate?
The IUPAC name of 2-phenoxyethyl N-(3-hydroxyphenyl)carbamate (CID 139715233) is 2-phenoxyethyl N-(3-hydroxyphenyl)carbamate.
What is the SMILES notation for 2-phenoxyethyl N-(3-hydroxyphenyl)carbamate?
The canonical SMILES for 2-phenoxyethyl N-(3-hydroxyphenyl)carbamate is O=C(Nc1cccc(O)c1)OCCOc1ccccc1.
What is the InChIKey of 2-phenoxyethyl N-(3-hydroxyphenyl)carbamate?
The InChIKey is NLJWHGGGGGDBAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO4/c17-13-6-4-5-12(11-13)16-15(18)20-10-9-19-14-7-2-1-3-8-14/h1-8,11,17H,9-10H2,(H,16,18).
What are the key properties of 2-phenoxyethyl N-(3-hydroxyphenyl)carbamate?
2-phenoxyethyl N-(3-hydroxyphenyl)carbamate has a molecular weight of 273.29 g/mol, XLogP of 3.02, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxyethyl N-(3-hydroxyphenyl)carbamate is sourced from PubChem (CID 139715233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).