methyl N-[2-(2-hydroxy-3-methoxyphenyl)ethyl]carbamate

C11H15NO4 — CID 15659643

IUPACmethyl N-[2-(2-hydroxy-3-methoxyphenyl)ethyl]carbamate
SMILESCOC(=O)NCCc1cccc(OC)c1O
InChIInChI=1S/C11H15NO4/c1-15-9-5-3-4-8(10(9)13)6-7-12-11(14)16-2/h3-5,13H,6-7H2,1-2H3,(H,12,14)
InChIKeyHQOHPAPPIORXIC-UHFFFAOYSA-N
MW225.24 g/mol
LogP1.30
Rot. Bonds4

About methyl N-[2-(2-hydroxy-3-methoxyphenyl)ethyl]carbamate

methyl N-[2-(2-hydroxy-3-methoxyphenyl)ethyl]carbamate (PubChem CID 15659643) has the molecular formula C11H15NO4 and a molecular weight of 225.24 g/mol. Its IUPAC name is methyl N-[2-(2-hydroxy-3-methoxyphenyl)ethyl]carbamate.

Molecular Properties

Compound Namemethyl N-[2-(2-hydroxy-3-methoxyphenyl)ethyl]carbamate
PubChem CID15659643
Molecular FormulaC11H15NO4
Molecular Weight225.24 g/mol
Exact Mass225.10
IUPAC Namemethyl N-[2-(2-hydroxy-3-methoxyphenyl)ethyl]carbamate
SMILESCOC(=O)NCCc1cccc(OC)c1O
InChIInChI=1S/C11H15NO4/c1-15-9-5-3-4-8(10(9)13)6-7-12-11(14)16-2/h3-5,13H,6-7H2,1-2H3,(H,12,14)
InChIKeyHQOHPAPPIORXIC-UHFFFAOYSA-N
XLogP1.30
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.24
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[2-(2-hydroxy-3-methoxyphenyl)ethylamino]-4-oxobutanoate
CID 9151605
N,N'-bis[(2-hydroxy-3-methoxyphenyl)methyl]oxamide
CID 139206905
methyl N-[2-[2-[(2-methylpropan-2-yl)oxy]phenyl]ethyl]carbamate
CID 110477722
1-ethyl-3-[2-(2-hydroxy-3-methoxyphenyl)ethyl]-2-[(2-methoxyphenyl)methyl]guanidine;hydroiodide
CID 111217858
ethane;2-methoxy-6-propylphenol
CID 142869062
methyl N-[2-[2-[[4,5-dimethoxy-2-[2-(methoxycarbonylamino)ethyl]phenyl]disulfanyl]-4,5-dimethoxyphenyl]ethyl]carbamate
CID 101093576
1-ethyl-3-[2-(2-hydroxy-3-methoxyphenyl)ethyl]-2-[(2-methylphenyl)methyl]guanidine;hydroiodide
CID 111360996
methyl N-[2-(5-ethyl-2-methoxyphenyl)ethyl]carbamate
CID 110788778
1-(2,6-dimethoxyphenyl)-3-[2-(2-methoxyphenyl)ethyl]urea
CID 108868095
2-(cyclobutylmethyl)-1-[2-(2-hydroxy-3-methoxyphenyl)ethyl]guanidine
CID 111100224
2-(3-ethoxypropyl)-1-[2-(2-hydroxy-3-methoxyphenyl)ethyl]guanidine
CID 111100210
2-heptadecyl-6-methoxyphenol
CID 10713705

Frequently Asked Questions

What is the IUPAC name of methyl N-[2-(2-hydroxy-3-methoxyphenyl)ethyl]carbamate?
The IUPAC name of methyl N-[2-(2-hydroxy-3-methoxyphenyl)ethyl]carbamate (CID 15659643) is methyl N-[2-(2-hydroxy-3-methoxyphenyl)ethyl]carbamate.
What is the SMILES notation for methyl N-[2-(2-hydroxy-3-methoxyphenyl)ethyl]carbamate?
The canonical SMILES for methyl N-[2-(2-hydroxy-3-methoxyphenyl)ethyl]carbamate is COC(=O)NCCc1cccc(OC)c1O.
What is the InChIKey of methyl N-[2-(2-hydroxy-3-methoxyphenyl)ethyl]carbamate?
The InChIKey is HQOHPAPPIORXIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO4/c1-15-9-5-3-4-8(10(9)13)6-7-12-11(14)16-2/h3-5,13H,6-7H2,1-2H3,(H,12,14).
What are the key properties of methyl N-[2-(2-hydroxy-3-methoxyphenyl)ethyl]carbamate?
methyl N-[2-(2-hydroxy-3-methoxyphenyl)ethyl]carbamate has a molecular weight of 225.24 g/mol, XLogP of 1.30, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-[2-(2-hydroxy-3-methoxyphenyl)ethyl]carbamate is sourced from PubChem (CID 15659643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).